data_1txx_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 1txx _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.239 0.507 0 CA-C-O 122.883 1.325 . . . . 100.0 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.07 -15.88 61.49 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.062 -0.972 . . . . 96.150000000000006 110.819 -179.581 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -112.32 25.49 11.47 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 122.652 1.215 . . . . 81.379999999999995 112.654 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.0 mm -123.13 142.87 38.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.279 -1.008 . . . . 43.43 108.279 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.93 128.71 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 113.812 -1.54 . . . . 24.699999999999999 111.745 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -98.99 119.33 37.6 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 122.744 1.259 . . . . 100.0 108.666 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.3 mt -104.42 160.33 15.0 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 113.394 -1.73 . . . . 63.359999999999999 113.1 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.5 p -131.26 165.76 22.67 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 111.844 -2.435 . . . . 34.18 106.233 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . 0.484 ' OD1' ' OG1' ' A' ' 66' ' ' THR . 64.5 m-20 -59.23 -28.92 67.14 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 117.849 -1.541 . . . . 100.0 110.113 -178.702 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -57.16 6.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 113.467 -1.697 . . . . 100.0 112.65 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 p -68.52 -5.9 22.17 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 116.289 1.959 . . . . 36.969999999999999 116.289 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -60.97 -43.74 98.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.102 1.519 . . . . 41.740000000000002 115.102 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . 0.672 ' OD2' ' NZ ' ' A' ' 18' ' ' LYS . 12.3 t70 -59.39 -48.53 81.3 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 124.113 1.911 . . . . 93.920000000000002 115.236 -176.65 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . 0.282 99.9 m -70.64 -60.84 2.02 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 110.78 -2.918 . . . . 59.509999999999998 112.576 -179.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.82 -21.65 66.03 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 117.804 2.52 . . . . 47.399999999999999 117.804 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.0 t -118.74 -66.37 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-O 122.632 1.206 . . . . 26.629999999999999 111.205 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mt -56.72 -43.41 80.61 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 116.628 2.084 . . . . 54.25 116.628 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . 0.672 ' NZ ' ' OD2' ' A' ' 13' ' ' ASP . 13.0 mptt -87.8 -15.02 38.04 Favored 'General case' 0 CA--C 1.491 -1.312 0 CA-C-O 122.537 1.16 . . . . 72.829999999999998 110.848 -178.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 146.82 4.65 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 112.47 -2.15 . . . . 29.210000000000001 114.88 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.361 0.0 OUTLIER -107.26 133.73 51.38 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 103.46 -2.793 . . . . 94.469999999999999 103.46 177.821 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . 0.656 ' N ' ' O ' ' A' ' 278' ' ' HOH . . . 97.36 168.73 32.93 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.534 2.396 . . . . 37.18 111.199 -178.552 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.86 130.03 41.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.373 -1.414 . . . . 24.469999999999999 113.013 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 mm -121.82 118.46 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 124.662 1.226 . . . . 24.0 113.28 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.4 tp -95.78 114.52 26.26 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-O 122.143 0.973 . . . . 25.859999999999999 111.724 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.0 t -109.02 131.97 58.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 119.481 -2.012 . . . . 27.149999999999999 113.778 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -102.01 107.04 18.05 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 126.286 1.834 . . . . 30.93 110.016 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -90.39 116.3 28.23 Favored 'General case' 0 CA--C 1.491 -1.311 0 N-CA-C 105.273 -2.121 . . . . 29.170000000000002 105.273 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -143.5 -179.39 6.4 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 125.285 2.469 . . . . 48.509999999999998 115.414 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.298 . . -143.31 165.18 28.2 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 124.03 1.871 . . . . 28.780000000000001 111.416 179.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -56.63 -55.23 36.64 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 110.361 -3.109 . . . . 100.0 118.55 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -99.4 32.01 2.92 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 116.136 1.902 . . . . 100.0 116.136 -175.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . 0.278 9.4 t -105.4 106.59 17.15 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.663 -1.608 . . . . 43.789999999999999 106.782 179.899 167.505 -135.331 67.744 105.718 2.076 102.851 85.701 -67.504 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.5 -37.57 75.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 115.372 1.619 . . . . 34.640000000000001 115.372 -178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 10.1 m95 -66.66 -31.19 71.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.044 -0.98 . . . . 38.700000000000003 111.46 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.9 m -62.81 -44.19 96.82 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.724 1.21 . . . . 34.880000000000003 107.878 177.628 -67.504 85.701 67.744 102.851 2.076 105.718 -135.331 167.505 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -28.37 66.87 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.778 -0.646 . . . . 100.0 112.36 178.204 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 -21.35 53.09 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 114.258 1.207 . . . . 100.0 114.258 -178.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 pt -96.96 -8.88 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 117.094 -1.843 . . . . 40.380000000000003 113.509 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.45 -40.92 79.4 Favored Pre-proline 0 C--N 1.308 -1.225 0 N-CA-C 114.541 1.311 . . . . 31.75 114.541 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -73.73 -35.44 4.54 Favored 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 120.365 0.71 . . . . 38.93 111.284 178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . 0.434 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.6 mp -63.31 -40.02 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.994 0 CA-C-O 123.459 1.6 . . . . 45.280000000000001 108.465 179.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -62.72 -31.89 72.9 Favored 'General case' 0 N--CA 1.425 -1.685 0 O-C-N 121.205 -0.934 . . . . 41.329999999999998 109.388 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -63.89 -51.11 66.04 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.567 -1.333 . . . . 43.850000000000001 112.67 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -43.92 97.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 115.36 1.615 . . . . 99.310000000000002 115.36 -179.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.256 1.2 mp -63.22 -42.51 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-O 123.187 1.47 . . . . 43.659999999999997 109.972 -178.137 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.24 -47.9 71.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.001 -1.909 . . . . 32.450000000000003 109.313 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.2 -39.13 89.43 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-N 114.609 -1.178 . . . . 45.939999999999998 111.342 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.71 -21.92 54.64 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 115.57 1.693 . . . . 100.0 115.57 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -105.48 18.22 22.6 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 115.881 1.808 . . . . 36.579999999999998 115.881 -179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -56.37 135.58 53.88 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.641 0.776 . . . . 50.090000000000003 111.517 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.73 -34.02 5.01 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.689 -1.364 . . . . 40.960000000000001 109.689 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.99 -28.35 12.06 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 122.014 0.911 . . . . 100.0 112.402 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -143.29 148.95 37.14 Favored 'General case' 0 N--CA 1.421 -1.89 0 C-N-CA 116.128 -2.229 . . . . 31.129999999999999 117.011 -174.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -115.88 124.8 51.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 N-CA-C 105.164 -2.162 . . . . 30.460000000000001 105.164 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -101.32 125.69 55.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 O-C-N 125.565 1.791 . . . . 30.09 109.411 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.84 148.97 45.92 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.904 -0.589 . . . . 41.619999999999997 111.905 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.98 154.15 31.39 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 124.202 0.939 . . . . 32.700000000000003 111.642 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.4 tp -138.52 112.37 8.41 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.646 1.841 . . . . 100.0 110.414 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -86.56 104.5 16.06 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.722 -1.214 . . . . 44.030000000000001 107.722 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 15.9 pt -65.81 -13.79 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.352 0 CA-C-N 114.39 -1.277 . . . . 75.900000000000006 113.207 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -72.38 -41.26 66.54 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 105.858 -1.904 . . . . 100.0 105.858 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -100.83 8.16 43.34 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.002 1.482 . . . . 100.0 115.002 -178.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -150.86 82.78 5.91 Favored Pre-proline 0 C--N 1.296 -1.725 0 N-CA-C 104.731 -2.322 . . . . 69.469999999999999 104.731 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -86.54 -1.29 8.3 Favored 'Trans proline' 0 N--CA 1.436 -1.907 0 C-N-CA 124.772 3.648 . . . . 46.390000000000001 117.845 -175.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -105.89 -12.06 26.87 Favored Glycine 0 CA--C 1.476 -2.386 1 C-N-CA 111.806 -4.997 . . . . 30.18 113.588 -177.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . 0.484 ' OG1' ' OD1' ' A' ' 9' ' ' ASP . 26.5 m -75.96 -50.69 14.2 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 116.052 -2.259 . . . . 38.18 115.678 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . 0.4 ' CB ' ' CD ' ' A' ' 68' ' ' PRO . . . -38.36 -59.98 1.15 Allowed Pre-proline 0 C--O 1.238 0.463 0 N-CA-C 115.968 1.84 . . . . 45.100000000000001 115.968 -178.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . 0.4 ' CD ' ' CB ' ' A' ' 67' ' ' ALA . 8.7 Cg_exo -45.69 -42.18 19.18 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 C-N-CA 124.434 3.422 . . . . 82.030000000000001 114.767 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.3 mttt -59.39 -28.9 67.32 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 118.971 -1.092 . . . . 100.0 109.346 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . 0.486 66.8 m-85 -97.82 2.8 49.77 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 117.732 2.493 . . . . 90.430000000000007 117.732 -178.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.71 18.12 79.24 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 119.446 -1.359 . . . . 50.399999999999999 113.239 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.1 mm -57.37 116.42 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.179 -1.011 . . . . 35.960000000000001 109.316 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.89 -34.01 9.97 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 122.636 1.207 . . . . 100.0 112.064 -178.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.17 168.01 33.98 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.808 -1.187 . . . . 31.32 110.38 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.4 pt -121.69 156.18 59.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 126.435 1.903 . . . . 95.819999999999993 116.043 -178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -76.43 154.9 98.07 Favored 'Cis proline' 0 N--CA 1.442 -1.51 0 C-N-CA 123.948 -1.271 . . . . 65.060000000000002 109.178 -4.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.5 m -131.62 135.57 47.06 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 105.118 -2.178 . . . . 23.780000000000001 105.118 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 117.302 -1.759 . . . . 59.57 109.294 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.9 mp -110.61 128.41 55.67 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 125.026 1.454 . . . . 38.82 110.677 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 tp -102.88 111.0 23.12 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.358 -1.349 . . . . 31.120000000000001 107.358 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . 0.477 ' CE2' ' CG2' ' A' ' 86' ' ' VAL . 69.0 m-85 -98.9 151.46 20.83 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 123.635 1.683 . . . . 47.649999999999999 112.797 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -149.97 119.49 6.94 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 111.047 -2.797 . . . . 33.369999999999997 110.305 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 52.48 40.98 30.72 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 114.585 -1.188 . . . . 66.400000000000006 112.201 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.29 16.8 78.68 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 116.117 1.207 . . . . 29.239999999999998 116.117 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -131.81 144.5 50.97 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.215 -1.402 . . . . 100.0 107.215 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . 0.477 ' CG2' ' CE2' ' A' ' 81' ' ' PHE . 25.3 t -76.23 128.63 37.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 C-N-CA 118.618 -1.233 . . . . 38.770000000000003 108.958 179.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -99.42 -31.03 11.86 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 123.03 1.395 . . . . 23.399999999999999 114.149 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -158.75 157.71 32.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.167 -1.379 . . . . 29.0 109.155 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.4 155.23 45.1 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 123.645 1.688 . . . . 59.899999999999999 112.188 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.44 125.3 17.05 Favored 'General case' 0 C--N 1.29 -1.991 0 O-C-N 120.193 -1.567 . . . . 46.439999999999998 107.745 178.037 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . 0.265 51.9 t -95.06 128.34 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-O 123.379 1.562 . . . . 25.82 114.469 177.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.67 165.83 41.76 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.402 1.721 . . . . 31.719999999999999 117.402 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.74 151.05 43.09 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.597 1.559 . . . . 33.310000000000002 113.282 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -153.37 168.98 24.27 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 125.544 1.538 . . . . 33.759999999999998 109.006 -178.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 89.2 p -85.8 175.13 8.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 123.516 1.627 . . . . 26.73 113.001 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.1 -40.32 90.66 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 116.007 -2.277 . . . . 51.939999999999998 109.543 178.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -58.21 -33.11 68.95 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 108.914 -1.674 . . . . 23.739999999999998 108.914 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -74.17 -44.71 52.45 Favored 'General case' 0 CA--C 1.485 -1.526 0 O-C-N 121.198 -1.177 . . . . 55.450000000000003 114.052 -178.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 7.0 tp -57.37 -45.77 84.06 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.221 2.826 . . . . 52.640000000000001 108.73 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -54.67 -51.77 64.43 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 114.183 1.179 . . . . 100.0 114.183 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -56.39 -45.44 80.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 123.056 1.408 . . . . 34.100000000000001 111.957 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -58.95 -47.28 85.63 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 114.852 -1.067 . . . . 69.299999999999997 112.233 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' A' ' 107' ' ' LEU . 94.8 mt -65.53 -50.76 64.04 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 119.989 -1.694 . . . . 29.91 109.979 177.735 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -54.77 -29.15 53.37 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 124.668 2.175 . . . . 72.959999999999994 112.016 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -77.81 -15.4 59.11 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 114.017 -3.073 . . . . 22.420000000000002 110.473 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . 0.407 ' N ' ' O ' ' A' ' 103' ' ' LEU . 68.3 m-80 -110.03 -32.16 7.12 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.221 -0.9 . . . . 55.219999999999999 112.827 -178.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . 0.522 ' N ' ' O ' ' A' ' 103' ' ' LEU 0.424 50.5 mt -61.53 125.03 22.34 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.062 -1.455 . . . . 35.240000000000002 112.932 -177.857 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.559 0 CA-C-O 115.676 -2.106 . . . . 100.0 110.63 -179.619 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . 0.633 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . 0.656 ' O ' ' N ' ' A' ' 21' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.239 0.507 0 CA-C-O 122.883 1.325 . . . . 100.0 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.07 -15.88 61.49 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.062 -0.972 . . . . 96.150000000000006 110.819 -179.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -112.32 25.49 11.47 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 122.652 1.215 . . . . 81.379999999999995 112.654 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.0 mm -123.13 142.87 38.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.279 -1.008 . . . . 43.43 108.279 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.93 128.71 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 113.812 -1.54 . . . . 24.699999999999999 111.745 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -98.99 119.33 37.6 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 122.744 1.259 . . . . 100.0 108.666 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.3 mt -104.42 160.33 15.0 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 113.394 -1.73 . . . . 63.359999999999999 113.1 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.5 p -131.26 165.76 22.67 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 111.844 -2.435 . . . . 34.18 106.233 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -59.23 -28.92 67.14 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 117.849 -1.541 . . . . 100.0 110.113 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -57.16 6.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 113.467 -1.697 . . . . 100.0 112.65 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 p -68.52 -5.9 22.17 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 116.289 1.959 . . . . 36.969999999999999 116.289 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' HE2' HD21 ' A' ' 17' ' ' LEU . 23.0 t80 -60.97 -43.74 98.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.102 1.519 . . . . 41.740000000000002 115.102 -177.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . 0.672 ' OD2' ' NZ ' ' A' ' 18' ' ' LYS . 12.3 t70 -59.39 -48.53 81.3 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 124.113 1.911 . . . . 93.920000000000002 115.236 -176.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . 0.282 99.9 m -70.64 -60.84 2.02 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 110.78 -2.918 . . . . 59.509999999999998 112.576 -179.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.82 -21.65 66.03 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 117.804 2.52 . . . . 47.399999999999999 117.804 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.0 t -118.74 -66.37 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-O 122.632 1.206 . . . . 26.629999999999999 111.205 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 17' ' ' LEU . 4.2 mt -56.72 -43.41 80.61 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 116.628 2.084 . . . . 54.25 116.628 -179.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . 0.672 ' NZ ' ' OD2' ' A' ' 13' ' ' ASP . 13.0 mptt -87.8 -15.02 38.04 Favored 'General case' 0 CA--C 1.491 -1.312 0 CA-C-O 122.537 1.16 . . . . 72.829999999999998 110.848 -178.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 146.82 4.65 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 112.47 -2.15 . . . . 29.210000000000001 114.88 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.361 0.0 OUTLIER -107.26 133.73 51.38 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 103.46 -2.793 . . . . 94.469999999999999 103.46 177.821 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.36 168.73 32.93 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.534 2.396 . . . . 37.18 111.199 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.86 130.03 41.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.373 -1.414 . . . . 24.469999999999999 113.013 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 mm -121.82 118.46 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 124.662 1.226 . . . . 24.0 113.28 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.4 tp -95.78 114.52 26.26 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-O 122.143 0.973 . . . . 25.859999999999999 111.724 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.0 t -109.02 131.97 58.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 119.481 -2.012 . . . . 27.149999999999999 113.778 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -102.01 107.04 18.05 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 126.286 1.834 . . . . 30.93 110.016 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -90.39 116.3 28.23 Favored 'General case' 0 CA--C 1.491 -1.311 0 N-CA-C 105.273 -2.121 . . . . 29.170000000000002 105.273 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -143.5 -179.39 6.4 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 125.285 2.469 . . . . 48.509999999999998 115.414 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.298 . . -143.31 165.18 28.2 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 124.03 1.871 . . . . 28.780000000000001 111.416 179.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 207' ' ' HOH . 2.2 tt0 -56.63 -55.23 36.64 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 110.361 -3.109 . . . . 100.0 118.55 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -99.4 32.01 2.92 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 116.136 1.902 . . . . 100.0 116.136 -175.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . 0.738 ' O ' ' HD2' ' A' ' 36' ' ' LYS 0.278 9.4 t -105.4 106.59 17.15 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.663 -1.608 . . . . 43.789999999999999 106.782 179.899 167.505 -135.331 67.744 105.718 2.076 102.851 85.701 -67.504 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . 0.483 ' HA ' ' HD3' ' A' ' 36' ' ' LYS . 9.1 p -60.5 -37.57 75.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 115.372 1.619 . . . . 34.640000000000001 115.372 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TRP . . . . . 0.472 ' HD1' ' O ' ' A' ' 250' ' ' HOH . 10.1 m95 -66.66 -31.19 71.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.044 -0.98 . . . . 38.700000000000003 111.46 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . 0.621 ' SG ' HD12 ' A' ' 75' ' ' ILE . 83.9 m -62.81 -44.19 96.82 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.724 1.21 . . . . 34.880000000000003 107.878 177.628 -67.504 85.701 67.744 102.851 2.076 105.718 -135.331 167.505 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . 0.738 ' HD2' ' O ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -68.6 -28.37 66.87 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.778 -0.646 . . . . 100.0 112.36 178.204 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 -21.35 53.09 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 114.258 1.207 . . . . 100.0 114.258 -178.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 pt -96.96 -8.88 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 117.094 -1.843 . . . . 40.380000000000003 113.509 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.45 -40.92 79.4 Favored Pre-proline 0 C--N 1.308 -1.225 0 N-CA-C 114.541 1.311 . . . . 31.75 114.541 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 5.7 Cg_exo -73.73 -35.44 4.54 Favored 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 120.365 0.71 . . . . 38.93 111.284 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . 0.551 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -63.31 -40.02 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.994 0 CA-C-O 123.459 1.6 . . . . 45.280000000000001 108.465 179.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -62.72 -31.89 72.9 Favored 'General case' 0 N--CA 1.425 -1.685 0 O-C-N 121.205 -0.934 . . . . 41.329999999999998 109.388 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -63.89 -51.11 66.04 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.567 -1.333 . . . . 43.850000000000001 112.67 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.75 -43.92 97.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 115.36 1.615 . . . . 99.310000000000002 115.36 -179.001 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . 0.463 ' CD1' ' HD2' ' A' ' 96' ' ' LYS 0.256 1.2 mp -63.22 -42.51 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-O 123.187 1.47 . . . . 43.659999999999997 109.972 -178.137 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.24 -47.9 71.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.001 -1.909 . . . . 32.450000000000003 109.313 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.2 -39.13 89.43 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-N 114.609 -1.178 . . . . 45.939999999999998 111.342 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.71 -21.92 54.64 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 115.57 1.693 . . . . 100.0 115.57 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 100' ' ' LYS . 44.8 m-85 -105.48 18.22 22.6 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 115.881 1.808 . . . . 36.579999999999998 115.881 -179.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -56.37 135.58 53.88 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.641 0.776 . . . . 50.090000000000003 111.517 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.73 -34.02 5.01 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.689 -1.364 . . . . 40.960000000000001 109.689 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.99 -28.35 12.06 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 122.014 0.911 . . . . 100.0 112.402 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -143.29 148.95 37.14 Favored 'General case' 0 N--CA 1.421 -1.89 0 C-N-CA 116.128 -2.229 . . . . 31.129999999999999 117.011 -174.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -115.88 124.8 51.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 N-CA-C 105.164 -2.162 . . . . 30.460000000000001 105.164 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -101.32 125.69 55.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 O-C-N 125.565 1.791 . . . . 30.09 109.411 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.84 148.97 45.92 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.904 -0.589 . . . . 41.619999999999997 111.905 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.98 154.15 31.39 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 124.202 0.939 . . . . 32.700000000000003 111.642 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.4 tp -138.52 112.37 8.41 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.646 1.841 . . . . 100.0 110.414 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 61' ' ' ASP . 27.1 t-20 -86.56 104.5 16.06 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.722 -1.214 . . . . 44.030000000000001 107.722 177.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 15.9 pt -65.81 -13.79 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.352 0 CA-C-N 114.39 -1.277 . . . . 75.900000000000006 113.207 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 79.2 m-20 -72.38 -41.26 66.54 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 105.858 -1.904 . . . . 100.0 105.858 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -100.83 8.16 43.34 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.002 1.482 . . . . 100.0 115.002 -178.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . 0.41 ' N ' ' HD3' ' A' ' 64' ' ' PRO . 66.8 m-80 -150.86 82.78 5.91 Favored Pre-proline 0 C--N 1.296 -1.725 0 N-CA-C 104.731 -2.322 . . . . 69.469999999999999 104.731 178.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 63' ' ' ASN . 10.0 Cg_endo -86.54 -1.29 8.3 Favored 'Trans proline' 0 N--CA 1.436 -1.907 0 C-N-CA 124.772 3.648 . . . . 46.390000000000001 117.845 -175.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . 0.534 ' O ' ' HE3' ' A' ' 69' ' ' LYS . . . -105.89 -12.06 26.87 Favored Glycine 0 CA--C 1.476 -2.386 1 C-N-CA 111.806 -4.997 . . . . 30.18 113.588 -177.104 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.709 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 26.5 m -75.96 -50.69 14.2 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 116.052 -2.259 . . . . 38.18 115.678 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . . . -38.36 -59.98 1.15 Allowed Pre-proline 0 C--O 1.238 0.463 0 N-CA-C 115.968 1.84 . . . . 45.100000000000001 115.968 -178.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 67' ' ' ALA . 8.7 Cg_exo -45.69 -42.18 19.18 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 C-N-CA 124.434 3.422 . . . . 82.030000000000001 114.767 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . 0.709 ' HE3' ' HA ' ' A' ' 66' ' ' THR . 34.3 mttt -59.39 -28.9 67.32 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 118.971 -1.092 . . . . 100.0 109.346 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . 0.486 66.8 m-85 -97.82 2.8 49.77 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 117.732 2.493 . . . . 90.430000000000007 117.732 -178.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.71 18.12 79.24 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 119.446 -1.359 . . . . 50.399999999999999 113.239 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.1 mm -57.37 116.42 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.179 -1.011 . . . . 35.960000000000001 109.316 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.89 -34.01 9.97 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 122.636 1.207 . . . . 100.0 112.064 -178.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.17 168.01 33.98 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.808 -1.187 . . . . 31.32 110.38 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.738 HD12 ' SG ' ' A' ' 32' ' ' CYS . 2.4 pt -121.69 156.18 59.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 126.435 1.903 . . . . 95.819999999999993 116.043 -178.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -76.43 154.9 98.07 Favored 'Cis proline' 0 N--CA 1.442 -1.51 0 C-N-CA 123.948 -1.271 . . . . 65.060000000000002 109.178 -4.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.5 m -131.62 135.57 47.06 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 105.118 -2.178 . . . . 23.780000000000001 105.118 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 117.302 -1.759 . . . . 59.57 109.294 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.9 mp -110.61 128.41 55.67 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 125.026 1.454 . . . . 38.82 110.677 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 tp -102.88 111.0 23.12 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.358 -1.349 . . . . 31.120000000000001 107.358 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . 0.524 ' CE2' HG23 ' A' ' 86' ' ' VAL . 69.0 m-85 -98.9 151.46 20.83 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 123.635 1.683 . . . . 47.649999999999999 112.797 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -149.97 119.49 6.94 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 111.047 -2.797 . . . . 33.369999999999997 110.305 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 52.48 40.98 30.72 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 114.585 -1.188 . . . . 66.400000000000006 112.201 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.29 16.8 78.68 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 116.117 1.207 . . . . 29.239999999999998 116.117 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -131.81 144.5 50.97 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.215 -1.402 . . . . 100.0 107.215 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.524 HG23 ' CE2' ' A' ' 81' ' ' PHE . 25.3 t -76.23 128.63 37.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 C-N-CA 118.618 -1.233 . . . . 38.770000000000003 108.958 179.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -99.42 -31.03 11.86 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 123.03 1.395 . . . . 23.399999999999999 114.149 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -158.75 157.71 32.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.167 -1.379 . . . . 29.0 109.155 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.4 155.23 45.1 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 123.645 1.688 . . . . 59.899999999999999 112.188 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -141.44 125.3 17.05 Favored 'General case' 0 C--N 1.29 -1.991 0 O-C-N 120.193 -1.567 . . . . 46.439999999999998 107.745 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . 0.265 51.9 t -95.06 128.34 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-O 123.379 1.562 . . . . 25.82 114.469 177.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.67 165.83 41.76 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.402 1.721 . . . . 31.719999999999999 117.402 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.74 151.05 43.09 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.597 1.559 . . . . 33.310000000000002 113.282 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . 0.401 HD13 ' HD2' ' A' ' 90' ' ' LYS . 0.9 OUTLIER -153.37 168.98 24.27 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 125.544 1.538 . . . . 33.759999999999998 109.006 -178.016 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . 0.505 ' OG ' ' HG3' ' A' ' 98' ' ' GLN . 89.2 p -85.8 175.13 8.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 123.516 1.627 . . . . 26.73 113.001 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.463 ' HD2' ' CD1' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -66.1 -40.32 90.66 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 116.007 -2.277 . . . . 51.939999999999998 109.543 178.427 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -58.21 -33.11 68.95 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 108.914 -1.674 . . . . 23.739999999999998 108.914 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . 0.505 ' HG3' ' OG ' ' A' ' 95' ' ' SER . 75.1 mt-30 -74.17 -44.71 52.45 Favored 'General case' 0 CA--C 1.485 -1.526 0 O-C-N 121.198 -1.177 . . . . 55.450000000000003 114.052 -178.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 7.0 tp -57.37 -45.77 84.06 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.221 2.826 . . . . 52.640000000000001 108.73 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.454 ' HG3' ' OH ' ' A' ' 49' ' ' TYR . 63.8 tttt -54.67 -51.77 64.43 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 114.183 1.179 . . . . 100.0 114.183 177.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -56.39 -45.44 80.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 123.056 1.408 . . . . 34.100000000000001 111.957 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -58.95 -47.28 85.63 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 114.852 -1.067 . . . . 69.299999999999997 112.233 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.53 -50.76 64.04 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 119.989 -1.694 . . . . 29.91 109.979 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -54.77 -29.15 53.37 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 124.668 2.175 . . . . 72.959999999999994 112.016 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -77.81 -15.4 59.11 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 114.017 -3.073 . . . . 22.420000000000002 110.473 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -110.03 -32.16 7.12 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.221 -0.9 . . . . 55.219999999999999 112.827 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . 0.424 50.5 mt -61.53 125.03 22.34 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.062 -1.455 . . . . 35.240000000000002 112.932 -177.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.559 0 CA-C-O 115.676 -2.106 . . . . 100.0 110.63 -179.619 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . 0.63 ' O ' ' HG3' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . 0.633 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . 0.472 ' O ' ' HD1' ' A' ' 34' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.239 0.507 0 CA-C-O 122.883 1.325 . . . . 100.0 110.882 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.07 -15.88 61.49 Favored 'General case' 0 N--CA 1.437 -1.094 0 CA-C-N 115.062 -0.972 . . . . 96.15 110.819 -179.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -112.32 25.49 11.47 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 122.652 1.215 . . . . 81.38 112.654 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.0 mm -123.13 142.87 38.14 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.279 -1.008 . . . . 43.43 108.279 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.93 128.71 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 113.812 -1.54 . . . . 24.7 111.745 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -98.99 119.33 37.6 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 122.744 1.259 . . . . 100.0 108.666 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.3 mt -104.42 160.33 15.0 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 113.394 -1.73 . . . . 63.36 113.1 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 5.5 p -131.26 165.76 22.67 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 111.844 -2.435 . . . . 34.18 106.233 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -59.23 -28.92 67.14 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 117.849 -1.541 . . . . 100.0 110.113 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -57.16 6.69 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 113.467 -1.697 . . . . 100.0 112.65 -179.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.6 p -68.52 -5.9 22.17 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 116.289 1.959 . . . . 36.97 116.289 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.441 ' HE2' HD21 ' A' ' 17' ' ' LEU . 23.0 t80 -60.97 -43.74 98.33 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 115.102 1.519 . . . . 41.74 115.102 -177.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.672 ' OD2' ' NZ ' ' A' ' 18' ' ' LYS . 12.3 t70 -59.39 -48.53 81.3 Favored 'General case' 0 C--O 1.25 1.126 0 CA-C-O 124.113 1.911 . . . . 93.92 115.236 -176.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . 0.282 99.9 m -70.64 -60.84 2.02 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 110.78 -2.918 . . . . 59.51 112.576 -179.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.82 -21.65 66.03 Favored 'General case' 0 CA--C 1.504 -0.8 0 N-CA-C 117.804 2.52 . . . . 47.4 117.804 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.0 t -118.74 -66.37 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-O 122.632 1.206 . . . . 26.63 111.205 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 17' ' ' LEU . 4.2 mt -56.72 -43.41 80.61 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 116.628 2.084 . . . . 54.25 116.628 -179.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.672 ' NZ ' ' OD2' ' A' ' 13' ' ' ASP . 13.0 mptt -87.8 -15.02 38.04 Favored 'General case' 0 CA--C 1.491 -1.312 0 CA-C-O 122.537 1.16 . . . . 72.83 110.848 -178.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -50.18 146.82 4.65 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 112.47 -2.15 . . . . 29.21 114.88 -178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . 0.361 0.0 OUTLIER -107.26 133.73 51.38 Favored 'General case' 0 N--CA 1.424 -1.749 0 N-CA-C 103.46 -2.793 . . . . 94.47 103.46 177.821 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.36 168.73 32.93 Favored Glycine 0 N--CA 1.441 -0.972 0 O-C-N 126.534 2.396 . . . . 37.18 111.199 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.86 130.03 41.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.373 -1.414 . . . . 24.47 113.013 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 mm -121.82 118.46 55.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 124.662 1.226 . . . . 24.0 113.28 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.4 tp -95.78 114.52 26.26 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-O 122.143 0.973 . . . . 25.86 111.724 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.0 t -109.02 131.97 58.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 119.481 -2.012 . . . . 27.15 113.778 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -102.01 107.04 18.05 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 126.286 1.834 . . . . 30.93 110.016 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -90.39 116.3 28.23 Favored 'General case' 0 CA--C 1.491 -1.311 0 N-CA-C 105.273 -2.121 . . . . 29.17 105.273 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -143.5 -179.39 6.4 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 125.285 2.469 . . . . 48.51 115.414 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . 0.298 . . -143.31 165.18 28.2 Favored 'General case' 0 N--CA 1.428 -1.573 0 CA-C-O 124.03 1.871 . . . . 28.78 111.416 179.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 207' ' ' HOH . 2.2 tt0 -56.63 -55.23 36.64 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 110.361 -3.109 . . . . 100.0 118.55 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -99.4 32.01 2.92 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 116.136 1.902 . . . . 100.0 116.136 -175.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.738 ' O ' ' HD2' ' A' ' 36' ' ' LYS 0.278 9.4 t -105.4 106.59 17.15 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 113.663 -1.608 . . . . 43.79 106.782 179.899 167.505 -135.331 67.744 105.718 2.076 102.851 85.701 -67.504 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.483 ' HA ' ' HD3' ' A' ' 36' ' ' LYS . 9.1 p -60.5 -37.57 75.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 115.372 1.619 . . . . 34.64 115.372 -178.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.472 ' HD1' ' O ' ' A' ' 250' ' ' HOH . 10.1 m95 -66.66 -31.19 71.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.044 -0.98 . . . . 38.7 111.46 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.621 ' SG ' HD12 ' A' ' 75' ' ' ILE . 83.9 m -62.81 -44.19 96.82 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 124.724 1.21 . . . . 34.88 107.878 177.628 -67.504 85.701 67.744 102.851 2.076 105.718 -135.331 167.505 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.738 ' HD2' ' O ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -68.6 -28.37 66.87 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.778 -0.646 . . . . 100.0 112.36 178.204 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 -21.35 53.09 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 114.258 1.207 . . . . 100.0 114.258 -178.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.1 pt -96.96 -8.88 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 117.094 -1.843 . . . . 40.38 113.509 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.45 -40.92 79.4 Favored Pre-proline 0 C--N 1.308 -1.225 0 N-CA-C 114.541 1.311 . . . . 31.75 114.541 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.412 ' O ' ' HG2' ' A' ' 44' ' ' GLU . 5.7 Cg_exo -73.73 -35.44 4.54 Favored 'Trans proline' 0 N--CA 1.438 -1.786 0 C-N-CA 120.365 0.71 . . . . 38.93 111.284 178.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.551 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -63.31 -40.02 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.994 0 CA-C-O 123.459 1.6 . . . . 45.28 108.465 179.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -62.72 -31.89 72.9 Favored 'General case' 0 N--CA 1.425 -1.685 0 O-C-N 121.205 -0.934 . . . . 41.33 109.388 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -63.89 -51.11 66.04 Favored 'General case' 0 C--O 1.248 0.976 0 O-C-N 120.567 -1.333 . . . . 43.85 112.67 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.75 -43.92 97.36 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 115.36 1.615 . . . . 99.31 115.36 -179.001 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.463 ' CD1' ' HD2' ' A' ' 96' ' ' LYS 0.256 1.2 mp -63.22 -42.51 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-O 123.187 1.47 . . . . 43.66 109.972 -178.137 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.24 -47.9 71.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-N 113.001 -1.909 . . . . 32.45 109.313 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -66.2 -39.13 89.43 Favored 'General case' 0 CA--C 1.494 -1.202 0 CA-C-N 114.609 -1.178 . . . . 45.94 111.342 -179.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.71 -21.92 54.64 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 115.57 1.693 . . . . 100.0 115.57 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 100' ' ' LYS . 44.8 m-85 -105.48 18.22 22.6 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 115.881 1.808 . . . . 36.58 115.881 -179.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -56.37 135.58 53.88 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.641 0.776 . . . . 50.09 111.517 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.73 -34.02 5.01 Favored Glycine 0 CA--C 1.536 1.352 0 N-CA-C 109.689 -1.364 . . . . 40.96 109.689 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.99 -28.35 12.06 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 122.014 0.911 . . . . 100.0 112.402 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -143.29 148.95 37.14 Favored 'General case' 0 N--CA 1.421 -1.89 0 C-N-CA 116.128 -2.229 . . . . 31.13 117.011 -174.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.3 m -115.88 124.8 51.55 Favored 'General case' 0 N--CA 1.426 -1.66 0 N-CA-C 105.164 -2.162 . . . . 30.46 105.164 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -101.32 125.69 55.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 O-C-N 125.565 1.791 . . . . 30.09 109.411 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.84 148.97 45.92 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.904 -0.589 . . . . 41.62 111.905 -177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.98 154.15 31.39 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 124.202 0.939 . . . . 32.7 111.642 177.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.4 tp -138.52 112.37 8.41 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 125.646 1.841 . . . . 100.0 110.414 178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 61' ' ' ASP . 27.1 t-20 -86.56 104.5 16.06 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.722 -1.214 . . . . 44.03 107.722 177.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 15.9 pt -65.81 -13.79 16.16 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.352 0 CA-C-N 114.39 -1.277 . . . . 75.9 113.207 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.401 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 79.2 m-20 -72.38 -41.26 66.54 Favored 'General case' 0 N--CA 1.438 -1.046 0 N-CA-C 105.858 -1.904 . . . . 100.0 105.858 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -100.83 8.16 43.34 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 115.002 1.482 . . . . 100.0 115.002 -178.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.41 ' N ' ' HD3' ' A' ' 64' ' ' PRO . 66.8 m-80 -150.86 82.78 5.91 Favored Pre-proline 0 C--N 1.296 -1.725 0 N-CA-C 104.731 -2.322 . . . . 69.47 104.731 178.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.41 ' HD3' ' N ' ' A' ' 63' ' ' ASN . 10.0 Cg_endo -86.54 -1.29 8.3 Favored 'Trans proline' 0 N--CA 1.436 -1.907 0 C-N-CA 124.772 3.648 . . . . 46.39 117.845 -175.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.534 ' O ' ' HE3' ' A' ' 69' ' ' LYS . . . -105.89 -12.06 26.87 Favored Glycine 0 CA--C 1.476 -2.386 1 C-N-CA 111.806 -4.997 . . . . 30.18 113.588 -177.104 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.709 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 26.5 m -75.96 -50.69 14.2 Favored 'General case' 0 C--N 1.306 -1.29 0 C-N-CA 116.052 -2.259 . . . . 38.18 115.678 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . . . -38.36 -59.98 1.15 Allowed Pre-proline 0 C--O 1.238 0.463 0 N-CA-C 115.968 1.84 . . . . 45.1 115.968 -178.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 67' ' ' ALA . 8.7 Cg_exo -45.69 -42.18 19.18 Favored 'Trans proline' 0 C--N 1.331 -0.371 0 C-N-CA 124.434 3.422 . . . . 82.03 114.767 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.709 ' HE3' ' HA ' ' A' ' 66' ' ' THR . 34.3 mttt -59.39 -28.9 67.32 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 118.971 -1.092 . . . . 100.0 109.346 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . 0.486 66.8 m-85 -97.82 2.8 49.77 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 117.732 2.493 . . . . 90.43 117.732 -178.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 76.71 18.12 79.24 Favored Glycine 0 C--N 1.311 -0.808 0 C-N-CA 119.446 -1.359 . . . . 50.4 113.239 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 23.1 mm -57.37 116.42 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 CA-C-N 114.179 -1.011 . . . . 35.96 109.316 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -100.89 -34.01 9.97 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 122.636 1.207 . . . . 100.0 112.064 -178.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -157.17 168.01 33.98 Favored Glycine 0 CA--C 1.497 -1.091 0 C-N-CA 119.808 -1.187 . . . . 31.32 110.38 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.738 HD12 ' SG ' ' A' ' 32' ' ' CYS . 2.4 pt -121.69 156.18 59.07 Favored Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 126.435 1.903 . . . . 95.82 116.043 -178.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -76.43 154.9 98.07 Favored 'Cis proline' 0 N--CA 1.442 -1.51 0 C-N-CA 123.948 -1.271 . . . . 65.06 109.178 -4.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.5 m -131.62 135.57 47.06 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 105.118 -2.178 . . . . 23.78 105.118 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.3 mt -112.9 127.14 56.12 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 117.302 -1.759 . . . . 59.57 109.294 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.9 mp -110.61 128.41 55.67 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 125.026 1.454 . . . . 38.82 110.677 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 tp -102.88 111.0 23.12 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.358 -1.349 . . . . 31.12 107.358 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.524 ' CE2' HG23 ' A' ' 86' ' ' VAL . 69.0 m-85 -98.9 151.46 20.83 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 123.635 1.683 . . . . 47.65 112.797 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -149.97 119.49 6.94 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 111.047 -2.797 . . . . 33.37 110.305 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 52.48 40.98 30.72 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-N 114.585 -1.188 . . . . 66.4 112.201 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 73.29 16.8 78.68 Favored Glycine 0 C--N 1.343 0.941 0 N-CA-C 116.117 1.207 . . . . 29.24 116.117 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -131.81 144.5 50.97 Favored 'General case' 0 CA--C 1.499 -1.005 0 N-CA-C 107.215 -1.402 . . . . 100.0 107.215 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.524 HG23 ' CE2' ' A' ' 81' ' ' PHE . 25.3 t -76.23 128.63 37.54 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 C-N-CA 118.618 -1.233 . . . . 38.77 108.958 179.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -99.42 -31.03 11.86 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 123.03 1.395 . . . . 23.4 114.149 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -158.75 157.71 32.21 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.167 -1.379 . . . . 29.0 109.155 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.4 155.23 45.1 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 123.645 1.688 . . . . 59.9 112.188 177.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' A' ' 94' ' ' LEU . 0.4 OUTLIER -141.44 125.3 17.05 Favored 'General case' 0 C--N 1.29 -1.991 0 O-C-N 120.193 -1.567 . . . . 46.44 107.745 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . 0.265 51.9 t -95.06 128.34 46.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-O 123.379 1.562 . . . . 25.82 114.469 177.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 87.67 165.83 41.76 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 117.402 1.721 . . . . 31.72 117.402 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.74 151.05 43.09 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.597 1.559 . . . . 33.31 113.282 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.401 HD13 ' HD2' ' A' ' 90' ' ' LYS . 0.9 OUTLIER -153.37 168.98 24.27 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 125.544 1.538 . . . . 33.76 109.006 -178.016 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . 0.505 ' OG ' ' HG3' ' A' ' 98' ' ' GLN . 89.2 p -85.8 175.13 8.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 123.516 1.627 . . . . 26.73 113.001 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.463 ' HD2' ' CD1' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -66.1 -40.32 90.66 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 116.007 -2.277 . . . . 51.94 109.543 178.427 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . -58.21 -33.11 68.95 Favored Glycine 0 CA--C 1.537 1.441 0 N-CA-C 108.914 -1.674 . . . . 23.74 108.914 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.505 ' HG3' ' OG ' ' A' ' 95' ' ' SER . 75.1 mt-30 -74.17 -44.71 52.45 Favored 'General case' 0 CA--C 1.485 -1.526 0 O-C-N 121.198 -1.177 . . . . 55.45 114.052 -178.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 7.0 tp -57.37 -45.77 84.06 Favored 'General case' 0 N--CA 1.45 -0.46 0 O-C-N 127.221 2.826 . . . . 52.64 108.73 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.454 ' HG3' ' OH ' ' A' ' 49' ' ' TYR . 63.8 tttt -54.67 -51.77 64.43 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 114.183 1.179 . . . . 100.0 114.183 177.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 -56.39 -45.44 80.59 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 123.056 1.408 . . . . 34.1 111.957 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -58.95 -47.28 85.63 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 114.852 -1.067 . . . . 69.3 112.233 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.53 -50.76 64.04 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 119.989 -1.694 . . . . 29.91 109.979 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -54.77 -29.15 53.37 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 124.668 2.175 . . . . 72.96 112.016 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -77.81 -15.4 59.11 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 114.017 -3.073 . . . . 22.42 110.473 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -110.03 -32.16 7.12 Favored 'General case' 0 C--O 1.217 -0.657 0 CA-C-N 115.221 -0.9 . . . . 55.22 112.827 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . 0.424 50.5 mt -61.53 125.03 22.34 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.062 -1.455 . . . . 35.24 112.932 -177.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.559 0 CA-C-O 115.676 -2.106 . . . . 100.0 110.63 -179.619 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . 0.63 ' O ' ' HG3' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . 0.633 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . 0.472 ' O ' ' HD1' ' A' ' 34' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_