data_1goa_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 1goa _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' ' ' MET . . . . . . . . . . . . 0.339 2.3 mtt . . . . . 0 CA--C 1.516 -0.345 1 CA-C-O 128.549 4.023 . . . . 54.76 112.722 . . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.604 0.0 OUTLIER 30.82 138.4 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.355 1 C-N-CA 140.761 7.625 . . . . 47.99 116.023 179.354 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.78 -68.33 0.6 Allowed 'General case' 0 CA--C 1.543 0.686 1 CA-C-N 108.268 -4.06 . . . . 45.19 106.235 179.855 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.84 -129.57 0.3 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 126.543 3.068 . . . . 46.94 117.468 -176.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.266 0.1 OUTLIER -160.77 131.19 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.398 -3.068 2 C-N-CA 147.795 10.438 . . . . 31.59 101.628 174.493 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -107.13 132.56 52.87 Favored 'General case' 0 C--N 1.28 -2.442 1 O-C-N 133.066 6.479 . . . . 23.85 106.089 177.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.2 mt -120.85 134.88 62.85 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 O-C-N 124.308 1.005 . . . . 15.35 110.824 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -124.96 131.98 53.34 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 126.098 2.124 . . . . 13.32 105.372 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 27.2 p -139.41 154.52 47.82 Favored 'General case' 0 C--N 1.344 0.354 0 O-C-N 125.694 1.871 . . . . 13.01 113.218 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -159.0 152.27 22.54 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 110.812 -2.904 . . . . 18.85 106.754 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -151.74 143.81 10.89 Favored Glycine 0 C--N 1.305 -1.169 0 N-CA-C 103.273 -3.931 . . . . 17.96 103.273 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -156.5 163.62 39.19 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 127.203 2.355 . . . . 30.5 110.102 -179.244 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . 0.306 0.8 OUTLIER -129.11 142.87 50.75 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 128.976 2.91 . . . . 28.7 118.083 -178.016 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.2 78.61 3.12 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 107.063 -1.458 . . . . 26.82 107.063 175.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.4 136.3 9.29 Favored Glycine 0 N--CA 1.495 2.58 1 N-CA-C 98.067 -6.013 . . . . 23.44 98.067 -177.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -130.14 108.8 16.54 Favored Pre-proline 0 N--CA 1.511 2.591 0 O-C-N 129.702 3.825 . . . . 25.81 103.31 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -75.37 145.79 84.39 Favored 'Cis proline' 0 C--N 1.304 -1.791 0 O-C-N 125.746 2.445 . . . . 19.33 112.377 1.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.63 -173.44 43.11 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 104.28 -3.528 . . . . 18.23 104.28 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -64.51 141.11 72.33 Favored 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 128.634 3.965 . . . . 15.22 107.93 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.66 169.44 24.36 Favored Glycine 0 C--O 1.257 1.576 0 CA-C-N 115.67 -0.695 . . . . 15.0 113.089 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -152.44 173.06 31.58 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 116.792 -2.623 . . . . 10.3 106.672 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -137.5 166.24 24.34 Favored 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 104.038 -2.579 . . . . 12.63 104.038 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.07 130.86 3.87 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 105.279 -3.128 . . . . 13.53 105.279 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.276 . . -138.77 144.91 39.61 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 124.728 2.204 . . . . 14.16 112.472 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.0 mp -121.72 132.76 70.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 O-C-N 119.833 -1.792 . . . . 17.46 107.55 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.7 tt -126.22 128.55 47.39 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.709 2.506 . . . . 19.39 106.097 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -118.05 99.41 6.88 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 118.016 -1.474 . . . . 24.96 110.442 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.65 -145.6 0.05 OUTLIER 'General case' 0 C--N 1.293 -1.873 0 O-C-N 127.458 2.974 . . . . 43.57 107.738 -179.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.5 mmm-85 -73.01 101.97 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.311 1.053 . . . . 50.59 110.231 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 49.11 14.25 0.45 Allowed Glycine 0 C--O 1.248 0.98 0 CA-C-N 113.624 -1.626 . . . . 40.29 111.843 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.94 158.77 32.77 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 119.417 1.608 . . . . 37.97 108.65 177.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -139.78 130.1 25.34 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 111.906 -2.406 . . . . 33.13 106.425 -178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . 0.284 1.3 mmtp -115.29 138.32 51.08 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 112.28 -2.236 . . . . 33.53 107.89 -176.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 p -112.83 155.81 24.0 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-O 116.125 -1.893 . . . . 22.55 106.197 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -136.74 150.71 48.56 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 128.309 2.643 . . . . 22.21 105.48 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . 0.345 0.4 OUTLIER -172.72 145.26 1.48 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 114.505 -2.664 . . . . 22.96 107.434 -176.024 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -168.82 151.33 4.97 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 129.085 3.991 . . . . 15.7 107.217 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -123.37 143.77 15.24 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 106.45 -2.66 . . . . 12.26 106.45 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -117.23 134.75 54.42 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 127.744 2.673 . . . . 18.71 110.18 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 36.7 m -53.32 -44.55 68.5 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 112.475 -2.148 . . . . 17.57 113.554 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' NH2' ' O ' ' A' ' 224' ' ' HOH . 6.7 ttt85 -156.82 120.44 4.23 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 126.932 2.645 . . . . 21.68 108.871 179.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . 0.44 ' OG1' ' OD1' ' A' ' 148' ' ' ASP . 13.9 t -158.79 -160.93 0.91 Allowed 'General case' 0 C--O 1.264 1.823 0 N-CA-C 106.936 -1.505 . . . . 13.45 106.936 -177.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -127.7 166.61 17.8 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 123.454 1.597 . . . . 13.22 112.174 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -56.94 -53.38 58.63 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 126.289 1.836 . . . . 29.12 110.925 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -53.45 -44.87 69.23 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 128.016 3.322 . . . . 17.9 111.404 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -68.97 -36.89 78.4 Favored 'General case' 0 CA--C 1.498 -1.038 0 O-C-N 127.788 3.18 . . . . 14.06 109.958 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 32.7 mmt -69.7 -42.73 73.67 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.813 -1.179 . . . . 9.98 110.929 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.22 -38.4 89.03 Favored 'General case' 0 C--O 1.274 2.366 0 O-C-N 120.723 -1.236 . . . . 18.46 111.879 177.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.26 -46.2 56.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 115.871 -2.014 . . . . 15.13 110.845 179.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 23.0 tpp -58.57 -39.27 79.82 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 127.806 3.191 . . . . 18.51 112.453 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.95 -47.55 74.36 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 118.442 -2.661 . . . . 8.9 108.818 176.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.09 -41.78 85.74 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.302 0.376 . . . . 14.07 110.685 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 48.4 mt -57.78 -51.52 69.27 Favored 'Isoleucine or valine' 0 C--O 1.279 2.617 0 N-CA-C 114.999 1.481 . . . . 15.58 114.999 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.2 -38.04 81.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 124.757 1.223 . . . . 17.37 112.091 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.17 -48.49 67.82 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 122.241 1.019 . . . . 16.87 111.514 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.6 mt -68.94 -34.6 75.62 Favored 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.269 2.228 . . . . 15.84 112.284 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -73.29 -12.82 60.98 Favored 'General case' 0 C--O 1.245 0.828 0 C-N-CA 118.059 -1.456 . . . . 16.88 110.68 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.84 -21.22 55.35 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 127.282 2.233 . . . . 21.25 114.923 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.5 mt -80.79 134.77 35.86 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 126.617 1.967 . . . . 26.59 108.259 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -120.82 8.48 10.54 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 128.655 3.722 . . . . 34.7 111.429 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.28 135.76 46.46 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.445 -2.057 . . . . 42.0 105.445 175.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -51.26 123.63 9.98 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 125.239 1.587 . . . . 32.84 107.228 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 62.5 m -120.24 169.16 10.52 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 124.035 1.874 . . . . 26.29 114.037 -177.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -105.11 106.7 17.3 Favored 'General case' 0 C--O 1.261 1.675 0 N-CA-C 100.532 -3.877 . . . . 42.36 100.532 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.9 t -108.62 141.97 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 N-CA-C 116.092 1.886 . . . . 17.24 116.092 -172.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.1 tp -118.53 110.9 31.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 106.658 -1.608 . . . . 20.39 106.658 169.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 tt -103.07 112.82 25.85 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 128.073 2.549 . . . . 15.6 112.145 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 t -106.33 116.16 31.46 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.825 -1.08 . . . . 22.25 111.788 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.9 t -144.13 159.14 43.15 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 120.21 -1.556 . . . . 13.5 112.748 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 p-10 -107.65 2.02 23.58 Favored 'General case' 0 C--O 1.272 2.273 0 CA-C-O 121.996 0.903 . . . . 20.88 112.996 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.7 t -61.16 132.66 54.44 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.62 1.2 . . . . 13.53 109.38 -177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -80.09 -28.43 39.08 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.692 1.234 . . . . 25.36 109.533 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -69.57 -51.69 33.09 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.378 -2.192 . . . . 11.64 112.236 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 17.8 t -61.63 -43.61 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 112.318 -2.219 . . . . 13.03 107.183 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.9 ttm180 -55.29 -45.93 76.23 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 113.658 -1.61 . . . . 36.4 112.225 -177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -59.16 -52.93 63.58 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.379 1.674 . . . . 24.46 111.102 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.53 -55.33 31.36 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 129.27 3.319 . . . . 15.5 110.772 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.54 -56.55 17.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 125.447 1.322 . . . . 18.29 112.473 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.2 p -60.87 -42.47 97.95 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 116.288 -1.815 . . . . 21.41 114.068 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . 0.53 ' NE2' ' CH2' ' A' ' 81' ' ' TRP . 26.7 mt-30 -82.36 5.52 20.02 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 131.652 3.981 . . . . 22.13 114.907 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 52.45 45.95 58.53 Favored Glycine 0 C--O 1.254 1.389 1 O-C-N 115.839 -4.288 . . . . 22.1 116.485 -179.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . 0.53 ' CH2' ' NE2' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -48.91 -69.98 0.1 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 122.242 3.021 . . . . 23.65 108.333 179.218 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 95.7 mt -38.15 -54.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 126.531 2.395 . . . . 20.37 112.267 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HIS . . . . . 0.564 ' N ' ' ND1' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -56.38 -53.73 53.86 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.474 1.109 . . . . 28.93 109.247 179.561 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -49.09 -59.48 3.6 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 127.305 2.242 . . . . 27.52 112.56 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . 0.41 ' CH2' ' CD1' ' A' ' 81' ' ' TRP . 44.9 m0 -56.4 -49.05 75.62 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 127.664 2.386 . . . . 20.1 116.22 177.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -58.54 -31.89 68.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.315 0.579 . . . . 23.64 110.865 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -74.58 -37.15 62.99 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.608 -1.626 . . . . 19.41 106.608 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -95.26 27.44 3.28 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 125.742 1.901 . . . . 37.2 114.798 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 60.14 24.48 60.97 Favored Glycine 0 C--N 1.291 -1.95 0 C-N-CA 127.151 2.31 . . . . 17.42 115.615 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 72.7 m95 67.54 29.07 7.35 Favored 'General case' 0 C--O 1.255 1.39 0 N-CA-C 116.774 2.138 . . . . 18.31 116.774 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -120.23 151.63 38.89 Favored 'General case' 0 C--N 1.311 -1.092 0 O-C-N 120.48 -1.388 . . . . 27.14 107.648 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 62.7 p -80.14 177.82 8.68 Favored 'General case' 0 C--O 1.264 1.849 0 CA-C-O 123.565 1.65 . . . . 23.13 108.335 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.28 -29.68 61.46 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.263 -1.335 . . . . 25.32 112.149 -178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -100.25 29.33 4.38 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.45 -0.5 . . . . 37.74 111.612 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt 57.92 23.95 10.41 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 127.854 3.221 . . . . 33.61 117.489 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 mtpt -96.89 154.83 38.15 Favored Pre-proline 0 C--O 1.258 1.546 0 N-CA-C 104.996 -2.224 . . . . 37.83 104.996 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.7 137.33 67.9 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 125.726 2.435 . . . . 14.96 108.579 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 34.5 m -60.33 155.43 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-O 124.774 2.226 . . . . 15.26 107.827 176.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.2 ttpt -68.52 132.24 46.63 Favored 'General case' 0 C--O 1.261 1.704 0 CA-C-N 112.332 -2.213 . . . . 32.7 107.565 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 58.53 37.99 25.44 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 127.768 2.427 . . . . 16.82 110.85 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -58.26 -32.11 43.96 Favored 'Isoleucine or valine' 0 C--O 1.254 1.327 0 O-C-N 126.992 2.682 . . . . 15.77 110.011 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -59.97 -45.07 93.9 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 124.979 1.424 . . . . 16.76 112.078 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 14.7 mt -73.38 -48.37 34.56 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 127.674 2.389 . . . . 11.87 112.601 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -55.68 -40.03 71.78 Favored 'General case' 0 C--O 1.281 2.732 0 CA-C-O 118.029 -0.986 . . . . 16.34 111.664 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -63.79 -45.23 90.63 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.33 1.019 . . . . 19.44 112.027 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -61.14 -38.59 86.93 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 126.37 2.294 . . . . 18.19 109.282 -179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.1 -58.3 7.07 Favored 'General case' 0 C--O 1.269 2.087 0 CA-C-O 116.333 -1.794 . . . . 16.91 111.262 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -43.2 -47.47 6.36 Favored 'General case' 0 C--O 1.255 1.37 0 O-C-N 127.565 3.041 . . . . 22.46 111.824 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.7 -36.22 78.27 Favored 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.775 -1.828 . . . . 21.42 112.326 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.16 -41.69 66.8 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.631 1.205 . . . . 20.68 112.346 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.3 mp -59.33 -32.13 69.8 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.997 -1.456 . . . . 23.08 114.651 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.06 -7.8 88.2 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 109.097 -1.601 . . . . 23.94 109.097 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -89.54 -48.96 6.96 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.964 0.888 . . . . 33.28 111.606 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -108.7 159.65 16.58 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 124.799 1.24 . . . . 21.35 113.877 -175.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -95.03 110.51 22.42 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 100.871 -3.752 . . . . 28.41 100.871 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 21.0 mt -109.74 140.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-O 123.839 1.781 . . . . 21.78 113.715 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -124.38 109.04 12.83 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.135 2.574 . . . . 31.37 105.75 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -84.04 141.39 31.2 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.276 -1.784 . . . . 20.46 109.859 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -132.09 111.46 11.49 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.586 -1.635 . . . . 35.01 106.586 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -93.87 118.89 32.07 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 124.16 1.933 . . . . 20.01 109.826 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.0 m -103.61 153.23 5.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 113.258 -1.792 . . . . 22.3 111.08 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 235' ' ' HOH . 1.2 tptm -139.25 101.86 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.374 -1.285 . . . . 27.94 109.943 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 96.86 142.94 13.9 Favored Glycine 0 N--CA 1.469 0.86 0 O-C-N 126.618 2.449 . . . . 28.0 111.335 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HIS . . . . . . . . . . . . . 45.6 m170 -74.39 -13.2 60.69 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 117.09 -1.434 . . . . 29.64 112.363 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.74 106.25 1.16 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 129.051 3.969 . . . . 27.77 108.306 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 78.14 34.48 37.17 Favored Glycine 0 C--O 1.245 0.79 0 O-C-N 127.929 3.268 . . . . 26.61 110.268 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -148.41 78.63 9.24 Favored Pre-proline 0 C--N 1.315 -0.91 0 O-C-N 127.219 2.364 . . . . 23.58 105.828 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.93 -37.27 2.16 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.46 2.107 . . . . 20.75 115.116 -174.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -61.42 -33.36 73.59 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.429 1.081 . . . . 29.34 111.161 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -75.64 -42.15 52.26 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 107.845 -1.169 . . . . 19.22 107.845 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -53.24 -47.88 68.66 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 117.244 -1.782 . . . . 31.98 106.563 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -54.6 -48.7 71.86 Favored 'General case' 0 C--O 1.262 1.736 0 O-C-N 126.726 2.516 . . . . 22.24 115.76 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 72.7 m -57.52 -38.49 74.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 123.915 0.76 . . . . 17.62 109.274 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -65.34 -43.93 89.38 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 124.175 0.922 . . . . 19.03 109.085 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.25 -39.75 93.88 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.443 1.089 . . . . 32.58 108.945 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.18 -44.89 78.55 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 125.11 1.506 . . . . 19.47 110.66 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.93 70.95 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 126.564 2.415 . . . . 16.95 111.226 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -69.4 -27.06 64.96 Favored 'General case' 0 C--O 1.252 1.235 0 O-C-N 124.656 1.222 . . . . 28.57 111.88 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.1 -50.85 24.8 Favored 'General case' 0 C--O 1.263 1.764 0 O-C-N 124.819 1.324 . . . . 20.15 109.406 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.16 75.85 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.201 0.815 . . . . 19.64 113.201 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -53.4 -24.95 13.79 Favored 'General case' 0 C--O 1.265 1.875 0 C-N-CA 126.978 2.111 . . . . 19.15 113.58 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 12.4 mmm -79.28 -18.76 52.07 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 129.45 3.1 . . . . 39.93 111.318 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . 0.656 ' ND2' ' O ' ' A' ' 240' ' ' HOH . 20.4 m-80 -140.04 67.14 33.58 Favored Pre-proline 0 N--CA 1.494 1.771 0 CA-C-O 124.429 2.061 . . . . 27.92 108.857 -177.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -66.38 132.89 30.69 Favored 'Trans proline' 0 C--O 1.26 1.587 0 CA-C-N 112.84 -1.521 . . . . 21.23 110.707 -175.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.0 p -120.95 -13.87 8.54 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.924 1.39 . . . . 18.17 111.616 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 18.2 mt -117.28 160.08 21.66 Favored 'General case' 0 C--N 1.313 -0.99 1 CA-C-O 128.723 4.106 . . . . 18.6 112.982 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 33.1 mp0 -107.41 133.47 51.88 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 110.394 -3.094 . . . . 30.06 103.203 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASP . . . . . 0.44 ' OD1' ' OG1' ' A' ' 42' ' ' THR . 39.4 t0 -97.94 94.61 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 101.718 -3.438 . . . . 19.02 101.718 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . 0.297 62.8 p -59.99 -38.26 82.05 Favored 'General case' 0 C--O 1.261 1.691 0 O-C-N 126.402 2.314 . . . . 27.03 117.077 -176.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -75.72 -0.59 64.17 Favored Glycine 0 N--CA 1.479 1.538 0 O-C-N 119.201 -2.187 . . . . 30.47 110.719 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -76.79 109.71 10.8 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 117.11 -1.836 . . . . 39.51 108.397 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' A' ' 239' ' ' HOH . 0.0 OUTLIER -94.17 135.68 35.28 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 111.595 -2.548 . . . . 50.07 106.128 178.69 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' VAL . . . . . . . . . . . . . 85.9 t -75.15 -60.66 2.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 O-C-N 128.001 3.313 . . . . 43.54 110.752 -177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -25.34 -108.32 0.0 OUTLIER 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 131.522 3.929 . . . . 53.68 119.391 -176.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.167 0 CA-C-O 113.757 -3.02 . . . . 47.12 104.662 179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.446 ' O ' ' NH2' ' A' ' 41' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.441 ' O ' ' N ' ' A' ' 122' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.581 ' O ' ' NE2' ' A' ' 152' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . 0.656 ' O ' ' ND2' ' A' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.339 2.3 mtt . . . . . 0 CA--C 1.516 -0.345 1 CA-C-O 128.549 4.023 . . . . 54.76 112.722 . . . . . . . . . 2 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.604 0.0 OUTLIER 30.82 138.4 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.355 1 C-N-CA 140.761 7.625 . . . . 47.99 116.023 179.354 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . 0.54 ' HB2' ' HG2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -132.78 -68.33 0.6 Allowed 'General case' 0 CA--C 1.543 0.686 1 CA-C-N 108.268 -4.06 . . . . 45.19 106.235 179.855 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.54 ' HG2' ' HB2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -115.84 -129.57 0.3 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 126.543 3.068 . . . . 46.94 117.468 -176.221 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' GLN 0.266 0.1 OUTLIER -160.77 131.19 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.398 -3.068 2 C-N-CA 147.795 10.438 . . . . 31.59 101.628 174.493 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -107.13 132.56 52.87 Favored 'General case' 0 C--N 1.28 -2.442 1 O-C-N 133.066 6.479 . . . . 23.85 106.089 177.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.2 mt -120.85 134.88 62.85 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 O-C-N 124.308 1.005 . . . . 15.35 110.824 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -124.96 131.98 53.34 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 126.098 2.124 . . . . 13.32 105.372 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . 0.445 ' HB ' ' HB1' ' A' ' 51' ' ' ALA . 27.2 p -139.41 154.52 47.82 Favored 'General case' 0 C--N 1.344 0.354 0 O-C-N 125.694 1.871 . . . . 13.01 113.218 -179.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -159.0 152.27 22.54 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 110.812 -2.904 . . . . 18.85 106.754 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 22' ' ' TYR . . . -151.74 143.81 10.89 Favored Glycine 0 C--N 1.305 -1.169 0 N-CA-C 103.273 -3.931 . . . . 17.96 103.273 175.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -156.5 163.62 39.19 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 127.203 2.355 . . . . 30.5 110.102 -179.244 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . 0.306 0.8 OUTLIER -129.11 142.87 50.75 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 128.976 2.91 . . . . 28.7 118.083 -178.016 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.2 78.61 3.12 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 107.063 -1.458 . . . . 26.82 107.063 175.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.4 136.3 9.29 Favored Glycine 0 N--CA 1.495 2.58 1 N-CA-C 98.067 -6.013 . . . . 23.44 98.067 -177.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -130.14 108.8 16.54 Favored Pre-proline 0 N--CA 1.511 2.591 0 O-C-N 129.702 3.825 . . . . 25.81 103.31 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -75.37 145.79 84.39 Favored 'Cis proline' 0 C--N 1.304 -1.791 0 O-C-N 125.746 2.445 . . . . 19.33 112.377 1.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.63 -173.44 43.11 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 104.28 -3.528 . . . . 18.23 104.28 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -64.51 141.11 72.33 Favored 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 128.634 3.965 . . . . 15.22 107.93 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.66 169.44 24.36 Favored Glycine 0 C--O 1.257 1.576 0 CA-C-N 115.67 -0.695 . . . . 15.0 113.089 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -152.44 173.06 31.58 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 116.792 -2.623 . . . . 10.3 106.672 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . 0.453 ' HA ' ' HA2' ' A' ' 11' ' ' GLY . 4.9 p90 -137.5 166.24 24.34 Favored 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 104.038 -2.579 . . . . 12.63 104.038 176.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.07 130.86 3.87 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 105.279 -3.128 . . . . 13.53 105.279 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.276 . . -138.77 144.91 39.61 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 124.728 2.204 . . . . 14.16 112.472 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.55 HG23 ' HG3' ' A' ' 32' ' ' GLU . 2.0 mp -121.72 132.76 70.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 O-C-N 119.833 -1.792 . . . . 17.46 107.55 177.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.617 HD22 ' O ' ' A' ' 210' ' ' HOH . 3.7 tt -126.22 128.55 47.39 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.709 2.506 . . . . 19.39 106.097 179.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . 0.647 ' HG2' ' HB2' ' A' ' 32' ' ' GLU . 44.8 mtt180 -118.05 99.41 6.88 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 118.016 -1.474 . . . . 24.96 110.442 179.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . 0.459 ' HE1' HD22 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -80.65 -145.6 0.05 OUTLIER 'General case' 0 C--N 1.293 -1.873 0 O-C-N 127.458 2.974 . . . . 43.57 107.738 -179.398 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . 0.549 ' O ' ' HG2' ' A' ' 31' ' ' ARG . 6.5 mmm-85 -73.01 101.97 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.311 1.053 . . . . 50.59 110.231 179.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 49.11 14.25 0.45 Allowed Glycine 0 C--O 1.248 0.98 0 CA-C-N 113.624 -1.626 . . . . 40.29 111.843 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -124.94 158.77 32.77 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 119.417 1.608 . . . . 37.97 108.65 177.195 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.647 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 6.5 tt0 -139.78 130.1 25.34 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 111.906 -2.406 . . . . 33.13 106.425 -178.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 203' ' ' HOH 0.284 1.3 mmtp -115.29 138.32 51.08 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 112.28 -2.236 . . . . 33.53 107.89 -176.831 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 p -112.83 155.81 24.0 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-O 116.125 -1.893 . . . . 22.55 106.197 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -136.74 150.71 48.56 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 128.309 2.643 . . . . 22.21 105.48 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . 0.345 0.4 OUTLIER -172.72 145.26 1.48 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 114.505 -2.664 . . . . 22.96 107.434 -176.024 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -168.82 151.33 4.97 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 129.085 3.991 . . . . 15.7 107.217 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -123.37 143.77 15.24 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 106.45 -2.66 . . . . 12.26 106.45 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -117.23 134.75 54.42 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 127.744 2.673 . . . . 18.71 110.18 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 36.7 m -53.32 -44.55 68.5 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 112.475 -2.148 . . . . 17.57 113.554 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.7 ttt85 -156.82 120.44 4.23 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 126.932 2.645 . . . . 21.68 108.871 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 13.9 t -158.79 -160.93 0.91 Allowed 'General case' 0 C--O 1.264 1.823 0 N-CA-C 106.936 -1.505 . . . . 13.45 106.936 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -127.7 166.61 17.8 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 123.454 1.597 . . . . 13.22 112.174 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 214' ' ' HOH . 1.3 m120 -56.94 -53.38 58.63 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 126.289 1.836 . . . . 29.12 110.925 177.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -53.45 -44.87 69.23 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 128.016 3.322 . . . . 17.9 111.404 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -68.97 -36.89 78.4 Favored 'General case' 0 CA--C 1.498 -1.038 0 O-C-N 127.788 3.18 . . . . 14.06 109.958 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 32.7 mmt -69.7 -42.73 73.67 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.813 -1.179 . . . . 9.98 110.929 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.22 -38.4 89.03 Favored 'General case' 0 C--O 1.274 2.366 0 O-C-N 120.723 -1.236 . . . . 18.46 111.879 177.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' A' ' 103' ' ' LEU . 0.4 OUTLIER -72.26 -46.2 56.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 115.871 -2.014 . . . . 15.13 110.845 179.696 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 23.0 tpp -58.57 -39.27 79.82 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 127.806 3.191 . . . . 18.51 112.453 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -54.95 -47.55 74.36 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 118.442 -2.661 . . . . 8.9 108.818 176.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HA ' HG21 ' A' ' 9' ' ' THR . . . -67.09 -41.78 85.74 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.302 0.376 . . . . 14.07 110.685 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 48.4 mt -57.78 -51.52 69.27 Favored 'Isoleucine or valine' 0 C--O 1.279 2.617 0 N-CA-C 114.999 1.481 . . . . 15.58 114.999 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.2 -38.04 81.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 124.757 1.223 . . . . 17.37 112.091 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -67.17 -48.49 67.82 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 122.241 1.019 . . . . 16.87 111.514 179.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.6 mt -68.94 -34.6 75.62 Favored 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.269 2.228 . . . . 15.84 112.284 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -73.29 -12.82 60.98 Favored 'General case' 0 C--O 1.245 0.828 0 C-N-CA 118.059 -1.456 . . . . 16.88 110.68 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . -76.84 -21.22 55.35 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 127.282 2.233 . . . . 21.25 114.923 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . 0.459 HD22 ' HE1' ' A' ' 28' ' ' TYR . 22.5 mt -80.79 134.77 35.86 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 126.617 1.967 . . . . 26.59 108.259 -179.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -120.82 8.48 10.54 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 128.655 3.722 . . . . 34.7 111.429 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.28 135.76 46.46 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.445 -2.057 . . . . 42.0 105.445 175.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -51.26 123.63 9.98 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 125.239 1.587 . . . . 32.84 107.228 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . 0.423 ' SG ' HD13 ' A' ' 59' ' ' LEU . 62.5 m -120.24 169.16 10.52 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 124.035 1.874 . . . . 26.29 114.037 -177.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . 0.47 ' O ' ' HB3' ' A' ' 4' ' ' GLN . 5.9 tt0 -105.11 106.7 17.3 Favored 'General case' 0 C--O 1.261 1.675 0 N-CA-C 100.532 -3.877 . . . . 42.36 100.532 171.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . 0.463 HG22 HG23 ' A' ' 5' ' ' VAL . 55.9 t -108.62 141.97 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 N-CA-C 116.092 1.886 . . . . 17.24 116.092 -172.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . 0.975 HD13 ' HD3' ' A' ' 117' ' ' LYS . 2.1 tp -118.53 110.9 31.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 106.658 -1.608 . . . . 20.39 106.658 169.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 tt -103.07 112.82 25.85 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 128.073 2.549 . . . . 15.6 112.145 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 t -106.33 116.16 31.46 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.825 -1.08 . . . . 22.25 111.788 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.9 t -144.13 159.14 43.15 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 120.21 -1.556 . . . . 13.5 112.748 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 p-10 -107.65 2.02 23.58 Favored 'General case' 0 C--O 1.272 2.273 0 CA-C-O 121.996 0.903 . . . . 20.88 112.996 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 255' ' ' HOH . 2.7 t -61.16 132.66 54.44 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.62 1.2 . . . . 13.53 109.38 -177.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -80.09 -28.43 39.08 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.692 1.234 . . . . 25.36 109.533 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -69.57 -51.69 33.09 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.378 -2.192 . . . . 11.64 112.236 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 17.8 t -61.63 -43.61 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 112.318 -2.219 . . . . 13.03 107.183 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.639 ' O ' HG23 ' A' ' 79' ' ' THR . 9.9 ttm180 -55.29 -45.93 76.23 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 113.658 -1.61 . . . . 36.4 112.225 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' GLN . 1.1 mt-30 -59.16 -52.93 63.58 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.379 1.674 . . . . 24.46 111.102 -179.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.53 -55.33 31.36 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 129.27 3.319 . . . . 15.5 110.772 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.54 -56.55 17.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 125.447 1.322 . . . . 18.29 112.473 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . 0.639 HG23 ' O ' ' A' ' 75' ' ' ARG . 8.2 p -60.87 -42.47 97.95 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 116.288 -1.815 . . . . 21.41 114.068 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 76' ' ' GLN . 82.2 mt-30 -82.36 5.52 20.02 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 131.652 3.981 . . . . 22.13 114.907 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 52.45 45.95 58.53 Favored Glycine 0 C--O 1.254 1.389 1 O-C-N 115.839 -4.288 . . . . 22.1 116.485 -179.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . 0.496 ' HB3' ' CZ3' ' A' ' 85' ' ' TRP . 0.0 OUTLIER -48.91 -69.98 0.1 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 122.242 3.021 . . . . 23.65 108.333 179.218 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 95.7 mt -38.15 -54.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 126.531 2.395 . . . . 20.37 112.267 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HIS . . . . . 0.564 ' N ' ' ND1' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -56.38 -53.73 53.86 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.474 1.109 . . . . 28.93 109.247 179.561 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -49.09 -59.48 3.6 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 127.305 2.242 . . . . 27.52 112.56 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 81' ' ' TRP . 44.9 m0 -56.4 -49.05 75.62 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 127.664 2.386 . . . . 20.1 116.22 177.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -58.54 -31.89 68.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.315 0.579 . . . . 23.64 110.865 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -74.58 -37.15 62.99 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.608 -1.626 . . . . 19.41 106.608 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -95.26 27.44 3.28 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 125.742 1.901 . . . . 37.2 114.798 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 60.14 24.48 60.97 Favored Glycine 0 C--N 1.291 -1.95 0 C-N-CA 127.151 2.31 . . . . 17.42 115.615 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 72.7 m95 67.54 29.07 7.35 Favored 'General case' 0 C--O 1.255 1.39 0 N-CA-C 116.774 2.138 . . . . 18.31 116.774 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -120.23 151.63 38.89 Favored 'General case' 0 C--N 1.311 -1.092 0 O-C-N 120.48 -1.388 . . . . 27.14 107.648 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 62.7 p -80.14 177.82 8.68 Favored 'General case' 0 C--O 1.264 1.849 0 CA-C-O 123.565 1.65 . . . . 23.13 108.335 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.28 -29.68 61.46 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.263 -1.335 . . . . 25.32 112.149 -178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -100.25 29.33 4.38 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.45 -0.5 . . . . 37.74 111.612 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . 0.804 ' HB3' ' O ' ' A' ' 248' ' ' HOH . 2.3 mmtt 57.92 23.95 10.41 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 127.854 3.221 . . . . 33.61 117.489 175.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 mtpt -96.89 154.83 38.15 Favored Pre-proline 0 C--O 1.258 1.546 0 N-CA-C 104.996 -2.224 . . . . 37.83 104.996 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.7 137.33 67.9 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 125.726 2.435 . . . . 14.96 108.579 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 85' ' ' TRP . 34.5 m -60.33 155.43 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-O 124.774 2.226 . . . . 15.26 107.827 176.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . 0.463 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 7.2 ttpt -68.52 132.24 46.63 Favored 'General case' 0 C--O 1.261 1.704 0 CA-C-N 112.332 -2.213 . . . . 32.7 107.565 177.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . 0.418 ' ND2' ' HE3' ' A' ' 99' ' ' LYS . 68.8 m-20 58.53 37.99 25.44 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 127.768 2.427 . . . . 16.82 110.85 -177.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.772 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 10.8 p -58.26 -32.11 43.96 Favored 'Isoleucine or valine' 0 C--O 1.254 1.327 0 O-C-N 126.992 2.682 . . . . 15.77 110.011 179.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' ARG . 14.0 p-10 -59.97 -45.07 93.9 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 124.979 1.424 . . . . 16.76 112.078 -178.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 49' ' ' LEU . 14.7 mt -73.38 -48.37 34.56 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 127.674 2.389 . . . . 11.87 112.601 -179.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -55.68 -40.03 71.78 Favored 'General case' 0 C--O 1.281 2.732 0 CA-C-O 118.029 -0.986 . . . . 16.34 111.664 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HG3' ' O ' ' A' ' 101' ' ' VAL . 68.5 mt-30 -63.79 -45.23 90.63 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.33 1.019 . . . . 19.44 112.027 176.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ASP . 64.6 mtp180 -61.14 -38.59 86.93 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 126.37 2.294 . . . . 18.19 109.282 -179.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.1 -58.3 7.07 Favored 'General case' 0 C--O 1.269 2.087 0 CA-C-O 116.333 -1.794 . . . . 16.91 111.262 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -43.2 -47.47 6.36 Favored 'General case' 0 C--O 1.255 1.37 0 O-C-N 127.565 3.041 . . . . 22.46 111.824 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.7 -36.22 78.27 Favored 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.775 -1.828 . . . . 21.42 112.326 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.16 -41.69 66.8 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.631 1.205 . . . . 20.68 112.346 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . 0.704 HD12 HD12 ' A' ' 116' ' ' ILE . 2.3 mp -59.33 -32.13 69.8 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.997 -1.456 . . . . 23.08 114.651 179.6 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.06 -7.8 88.2 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 109.097 -1.601 . . . . 23.94 109.097 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -89.54 -48.96 6.96 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.964 0.888 . . . . 33.28 111.606 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -108.7 159.65 16.58 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 124.799 1.24 . . . . 21.35 113.877 -175.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -95.03 110.51 22.42 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 100.871 -3.752 . . . . 28.41 100.871 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . 0.704 HD12 HD12 ' A' ' 111' ' ' LEU . 21.0 mt -109.74 140.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-O 123.839 1.781 . . . . 21.78 113.715 -175.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . 0.975 ' HD3' HD13 ' A' ' 66' ' ' ILE . 13.6 tmtt? -124.38 109.04 12.83 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.135 2.574 . . . . 31.37 105.75 179.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -84.04 141.39 31.2 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.276 -1.784 . . . . 20.46 109.859 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . 0.609 ' HB2' HD11 ' A' ' 66' ' ' ILE . 2.5 tt0 -132.09 111.46 11.49 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.586 -1.635 . . . . 35.01 106.586 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -93.87 118.89 32.07 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 124.16 1.933 . . . . 20.01 109.826 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.0 m -103.61 153.23 5.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 113.258 -1.792 . . . . 22.3 111.08 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 235' ' ' HOH . 1.2 tptm -139.25 101.86 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.374 -1.285 . . . . 27.94 109.943 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 96.86 142.94 13.9 Favored Glycine 0 N--CA 1.469 0.86 0 O-C-N 126.618 2.449 . . . . 28.0 111.335 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HIS . . . . . 0.523 ' HB3' ' HG3' ' A' ' 131' ' ' GLU . 45.6 m170 -74.39 -13.2 60.69 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 117.09 -1.434 . . . . 29.64 112.363 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.74 106.25 1.16 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 129.051 3.969 . . . . 27.77 108.306 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 78.14 34.48 37.17 Favored Glycine 0 C--O 1.245 0.79 0 O-C-N 127.929 3.268 . . . . 26.61 110.268 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -148.41 78.63 9.24 Favored Pre-proline 0 C--N 1.315 -0.91 0 O-C-N 127.219 2.364 . . . . 23.58 105.828 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.93 -37.27 2.16 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.46 2.107 . . . . 20.75 115.116 -174.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -61.42 -33.36 73.59 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.429 1.081 . . . . 29.34 111.161 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -75.64 -42.15 52.26 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 107.845 -1.169 . . . . 19.22 107.845 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . 0.523 ' HG3' ' HB3' ' A' ' 124' ' ' HIS . 4.8 mt-10 -53.24 -47.88 68.66 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 117.244 -1.782 . . . . 31.98 106.563 177.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -54.6 -48.7 71.86 Favored 'General case' 0 C--O 1.262 1.736 0 O-C-N 126.726 2.516 . . . . 22.24 115.76 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 72.7 m -57.52 -38.49 74.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 123.915 0.76 . . . . 17.62 109.274 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -65.34 -43.93 89.38 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 124.175 0.922 . . . . 19.03 109.085 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.25 -39.75 93.88 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.443 1.089 . . . . 32.58 108.945 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.18 -44.89 78.55 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 125.11 1.506 . . . . 19.47 110.66 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.93 70.95 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 126.564 2.415 . . . . 16.95 111.226 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -69.4 -27.06 64.96 Favored 'General case' 0 C--O 1.252 1.235 0 O-C-N 124.656 1.222 . . . . 28.57 111.88 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.1 -50.85 24.8 Favored 'General case' 0 C--O 1.263 1.764 0 O-C-N 124.819 1.324 . . . . 20.15 109.406 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.16 75.85 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.201 0.815 . . . . 19.64 113.201 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -53.4 -24.95 13.79 Favored 'General case' 0 C--O 1.265 1.875 0 C-N-CA 126.978 2.111 . . . . 19.15 113.58 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 12.4 mmm -79.28 -18.76 52.07 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 129.45 3.1 . . . . 39.93 111.318 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . 0.458 ' N ' ' HD3' ' A' ' 144' ' ' PRO . 20.4 m-80 -140.04 67.14 33.58 Favored Pre-proline 0 N--CA 1.494 1.771 0 CA-C-O 124.429 2.061 . . . . 27.92 108.857 -177.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' A' ' 143' ' ' ASN . 2.3 Cg_endo -66.38 132.89 30.69 Favored 'Trans proline' 0 C--O 1.26 1.587 0 CA-C-N 112.84 -1.521 . . . . 21.23 110.707 -175.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.0 p -120.95 -13.87 8.54 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.924 1.39 . . . . 18.17 111.616 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 18.2 mt -117.28 160.08 21.66 Favored 'General case' 0 C--N 1.313 -0.99 1 CA-C-O 128.723 4.106 . . . . 18.6 112.982 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 33.1 mp0 -107.41 133.47 51.88 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 110.394 -3.094 . . . . 30.06 103.203 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -97.94 94.61 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 101.718 -3.438 . . . . 19.02 101.718 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . 0.297 62.8 p -59.99 -38.26 82.05 Favored 'General case' 0 C--O 1.261 1.691 0 O-C-N 126.402 2.314 . . . . 27.03 117.077 -176.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -75.72 -0.59 64.17 Favored Glycine 0 N--CA 1.479 1.538 0 O-C-N 119.201 -2.187 . . . . 30.47 110.719 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -76.79 109.71 10.8 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 117.11 -1.836 . . . . 39.51 108.397 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' A' ' 239' ' ' HOH . 0.0 OUTLIER -94.17 135.68 35.28 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 111.595 -2.548 . . . . 50.07 106.128 178.69 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 153' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 243' ' ' HOH . 85.9 t -75.15 -60.66 2.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 O-C-N 128.001 3.313 . . . . 43.54 110.752 -177.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLU . . . . . 0.436 ' HB3' ' H ' ' A' ' 155' ' ' VAL . 2.9 tp10 -25.34 -108.32 0.0 OUTLIER 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 131.522 3.929 . . . . 53.68 119.391 -176.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . 0.436 ' H ' ' HB3' ' A' ' 154' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.167 0 CA-C-O 113.757 -3.02 . . . . 47.12 104.662 179.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.418 ' O ' ' HD3' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 . . . . . 0.617 ' O ' HD22 ' A' ' 26' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.407 ' O ' ' HB3' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 . . . . . 0.404 ' O ' ' HG3' ' A' ' 131' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.441 ' O ' ' N ' ' A' ' 122' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.581 ' O ' ' NE2' ' A' ' 152' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . 0.407 ' O ' ' ND2' ' A' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.599 ' O ' HG13 ' A' ' 153' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.804 ' O ' ' HB3' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.466 ' O ' ' HA ' ' A' ' 71' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.339 2.3 mtt . . . . . 0 CA--C 1.516 -0.345 1 CA-C-O 128.549 4.023 . . . . 54.76 112.722 . . . . . . . . . 2 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.604 0.0 OUTLIER 30.82 138.4 0.0 OUTLIER 'General case' 0 N--CA 1.412 -2.355 1 C-N-CA 140.761 7.625 . . . . 47.99 116.023 179.354 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.54 ' HB2' ' HG2' ' A' ' 4' ' ' GLN . 0.0 OUTLIER -132.78 -68.33 0.6 Allowed 'General case' 0 CA--C 1.543 0.686 1 CA-C-N 108.268 -4.06 . . . . 45.19 106.235 179.855 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.758 HE21 ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -115.84 -129.57 0.3 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 126.543 3.068 . . . . 46.94 117.468 -176.221 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.532 ' O ' ' HB2' ' A' ' 4' ' ' GLN 0.266 0.1 OUTLIER -160.77 131.19 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.398 -3.068 2 C-N-CA 147.795 10.438 . . . . 31.59 101.628 174.493 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -107.13 132.56 52.87 Favored 'General case' 0 C--N 1.28 -2.442 1 O-C-N 133.066 6.479 . . . . 23.85 106.089 177.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 43.2 mt -120.85 134.88 62.85 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.743 0 O-C-N 124.308 1.005 . . . . 15.35 110.824 179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -124.96 131.98 53.34 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 126.098 2.124 . . . . 13.32 105.372 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . 0.445 ' HB ' ' HB1' ' A' ' 51' ' ' ALA . 27.2 p -139.41 154.52 47.82 Favored 'General case' 0 C--N 1.344 0.354 0 O-C-N 125.694 1.871 . . . . 13.01 113.218 -179.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -159.0 152.27 22.54 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-N 110.812 -2.904 . . . . 18.85 106.754 174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 22' ' ' TYR . . . -151.74 143.81 10.89 Favored Glycine 0 C--N 1.305 -1.169 0 N-CA-C 103.273 -3.931 . . . . 17.96 103.273 175.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -156.5 163.62 39.19 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 127.203 2.355 . . . . 30.5 110.102 -179.244 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . 0.306 0.8 OUTLIER -129.11 142.87 50.75 Favored 'General case' 0 N--CA 1.439 -1.01 0 C-N-CA 128.976 2.91 . . . . 28.7 118.083 -178.016 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.2 78.61 3.12 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 107.063 -1.458 . . . . 26.82 107.063 175.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.4 136.3 9.29 Favored Glycine 0 N--CA 1.495 2.58 1 N-CA-C 98.067 -6.013 . . . . 23.44 98.067 -177.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -130.14 108.8 16.54 Favored Pre-proline 0 N--CA 1.511 2.591 0 O-C-N 129.702 3.825 . . . . 25.81 103.31 -177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -75.37 145.79 84.39 Favored 'Cis proline' 0 C--N 1.304 -1.791 0 O-C-N 125.746 2.445 . . . . 19.33 112.377 1.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.63 -173.44 43.11 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 104.28 -3.528 . . . . 18.23 104.28 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -64.51 141.11 72.33 Favored 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 128.634 3.965 . . . . 15.22 107.93 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.66 169.44 24.36 Favored Glycine 0 C--O 1.257 1.576 0 CA-C-N 115.67 -0.695 . . . . 15.0 113.089 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -152.44 173.06 31.58 Favored Glycine 0 N--CA 1.493 2.47 0 C-N-CA 116.792 -2.623 . . . . 10.3 106.672 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.453 ' HA ' ' HA2' ' A' ' 11' ' ' GLY . 4.9 p90 -137.5 166.24 24.34 Favored 'General case' 0 N--CA 1.516 2.853 0 N-CA-C 104.038 -2.579 . . . . 12.63 104.038 176.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.07 130.86 3.87 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 105.279 -3.128 . . . . 13.53 105.279 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . 0.276 . . -138.77 144.91 39.61 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-O 124.728 2.204 . . . . 14.16 112.472 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.55 HG23 ' HG3' ' A' ' 32' ' ' GLU . 2.0 mp -121.72 132.76 70.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.143 0 O-C-N 119.833 -1.792 . . . . 17.46 107.55 177.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.617 HD22 ' O ' ' A' ' 210' ' ' HOH . 3.7 tt -126.22 128.55 47.39 Favored 'General case' 0 C--O 1.28 2.665 0 O-C-N 126.709 2.506 . . . . 19.39 106.097 179.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.647 ' HG2' ' HB2' ' A' ' 32' ' ' GLU . 44.8 mtt180 -118.05 99.41 6.88 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 118.016 -1.474 . . . . 24.96 110.442 179.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.459 ' HE1' HD22 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -80.65 -145.6 0.05 OUTLIER 'General case' 0 C--N 1.293 -1.873 0 O-C-N 127.458 2.974 . . . . 43.57 107.738 -179.398 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.549 ' O ' ' HG2' ' A' ' 31' ' ' ARG . 6.5 mmm-85 -73.01 101.97 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.311 1.053 . . . . 50.59 110.231 179.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 49.11 14.25 0.45 Allowed Glycine 0 C--O 1.248 0.98 0 CA-C-N 113.624 -1.626 . . . . 40.29 111.843 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -124.94 158.77 32.77 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 119.417 1.608 . . . . 37.97 108.65 177.195 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.647 ' HB2' ' HG2' ' A' ' 27' ' ' ARG . 6.5 tt0 -139.78 130.1 25.34 Favored 'General case' 0 N--CA 1.503 2.213 0 CA-C-N 111.906 -2.406 . . . . 33.13 106.425 -178.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 203' ' ' HOH 0.284 1.3 mmtp -115.29 138.32 51.08 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 112.28 -2.236 . . . . 33.53 107.89 -176.831 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 p -112.83 155.81 24.0 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-O 116.125 -1.893 . . . . 22.55 106.197 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -136.74 150.71 48.56 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 128.309 2.643 . . . . 22.21 105.48 177.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . 0.345 0.4 OUTLIER -172.72 145.26 1.48 Allowed 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 114.505 -2.664 . . . . 22.96 107.434 -176.024 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -168.82 151.33 4.97 Favored 'General case' 0 C--N 1.293 -1.849 0 O-C-N 129.085 3.991 . . . . 15.7 107.217 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -123.37 143.77 15.24 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 106.45 -2.66 . . . . 12.26 106.45 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -117.23 134.75 54.42 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 127.744 2.673 . . . . 18.71 110.18 -178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 36.7 m -53.32 -44.55 68.5 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 112.475 -2.148 . . . . 17.57 113.554 -176.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.7 ttt85 -156.82 120.44 4.23 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 126.932 2.645 . . . . 21.68 108.871 179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 13.9 t -158.79 -160.93 0.91 Allowed 'General case' 0 C--O 1.264 1.823 0 N-CA-C 106.936 -1.505 . . . . 13.45 106.936 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -127.7 166.61 17.8 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 123.454 1.597 . . . . 13.22 112.174 175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 214' ' ' HOH . 5.1 m-80 -56.94 -53.38 58.63 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 126.289 1.836 . . . . 29.12 110.925 177.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -53.45 -44.87 69.23 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 128.016 3.322 . . . . 17.9 111.404 179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -68.97 -36.89 78.4 Favored 'General case' 0 CA--C 1.498 -1.038 0 O-C-N 127.788 3.18 . . . . 14.06 109.958 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 32.7 mmt -69.7 -42.73 73.67 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.813 -1.179 . . . . 9.98 110.929 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -62.22 -38.4 89.03 Favored 'General case' 0 C--O 1.274 2.366 0 O-C-N 120.723 -1.236 . . . . 18.46 111.879 177.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' A' ' 103' ' ' LEU . 0.4 OUTLIER -72.26 -46.2 56.9 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 115.871 -2.014 . . . . 15.13 110.845 179.696 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 23.0 tpp -58.57 -39.27 79.82 Favored 'General case' 0 C--O 1.266 1.931 0 O-C-N 127.806 3.191 . . . . 18.51 112.453 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 9' ' ' THR . . . -54.95 -47.55 74.36 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 118.442 -2.661 . . . . 8.9 108.818 176.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.415 ' HA ' HG21 ' A' ' 9' ' ' THR . . . -67.09 -41.78 85.74 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 123.302 0.376 . . . . 14.07 110.685 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 48.4 mt -57.78 -51.52 69.27 Favored 'Isoleucine or valine' 0 C--O 1.279 2.617 0 N-CA-C 114.999 1.481 . . . . 15.58 114.999 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.2 -38.04 81.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 124.757 1.223 . . . . 17.37 112.091 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -67.17 -48.49 67.82 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 122.241 1.019 . . . . 16.87 111.514 179.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 31.6 mt -68.94 -34.6 75.62 Favored 'General case' 0 N--CA 1.441 -0.899 0 C-N-CA 127.269 2.228 . . . . 15.84 112.284 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 84.6 mt-10 -73.29 -12.82 60.98 Favored 'General case' 0 C--O 1.245 0.828 0 C-N-CA 118.059 -1.456 . . . . 16.88 110.68 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . -76.84 -21.22 55.35 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 127.282 2.233 . . . . 21.25 114.923 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.459 HD22 ' HE1' ' A' ' 28' ' ' TYR . 22.5 mt -80.79 134.77 35.86 Favored 'General case' 0 C--N 1.312 -1.065 0 C-N-CA 126.617 1.967 . . . . 26.59 108.259 -179.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.4 mmtp -120.82 8.48 10.54 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 128.655 3.722 . . . . 34.7 111.429 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -132.28 135.76 46.46 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.445 -2.057 . . . . 42.0 105.445 175.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 85.9 m-70 -51.26 123.63 9.98 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 125.239 1.587 . . . . 32.84 107.228 179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.423 ' SG ' HD13 ' A' ' 59' ' ' LEU . 62.5 m -120.24 169.16 10.52 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 124.035 1.874 . . . . 26.29 114.037 -177.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.758 ' HG2' HE21 ' A' ' 4' ' ' GLN . 5.9 tt0 -105.11 106.7 17.3 Favored 'General case' 0 C--O 1.261 1.675 0 N-CA-C 100.532 -3.877 . . . . 42.36 100.532 171.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.463 HG22 HG23 ' A' ' 5' ' ' VAL . 55.9 t -108.62 141.97 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 N-CA-C 116.092 1.886 . . . . 17.24 116.092 -172.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.975 HD13 ' HD3' ' A' ' 117' ' ' LYS . 2.1 tp -118.53 110.9 31.7 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 106.658 -1.608 . . . . 20.39 106.658 169.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.7 tt -103.07 112.82 25.85 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 128.073 2.549 . . . . 15.6 112.145 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.7 t -106.33 116.16 31.46 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.825 -1.08 . . . . 22.25 111.788 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 11.9 t -144.13 159.14 43.15 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 120.21 -1.556 . . . . 13.5 112.748 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.3 p-10 -107.65 2.02 23.58 Favored 'General case' 0 C--O 1.272 2.273 0 CA-C-O 121.996 0.903 . . . . 20.88 112.996 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . 0.466 ' HA ' ' O ' ' A' ' 255' ' ' HOH . 2.7 t -61.16 132.66 54.44 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 122.62 1.2 . . . . 13.53 109.38 -177.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 -80.09 -28.43 39.08 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 122.692 1.234 . . . . 25.36 109.533 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -69.57 -51.69 33.09 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 112.378 -2.192 . . . . 11.64 112.236 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 17.8 t -61.63 -43.61 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.858 0 CA-C-N 112.318 -2.219 . . . . 13.03 107.183 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.639 ' O ' HG23 ' A' ' 79' ' ' THR . 9.9 ttm180 -55.29 -45.93 76.23 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 113.658 -1.61 . . . . 36.4 112.225 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 80' ' ' GLN . 5.0 mt-30 -59.16 -52.93 63.58 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 125.379 1.674 . . . . 24.46 111.102 -179.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.53 -55.33 31.36 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 129.27 3.319 . . . . 15.5 110.772 -179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.54 -56.55 17.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 O-C-N 125.447 1.322 . . . . 18.29 112.473 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . 0.639 HG23 ' O ' ' A' ' 75' ' ' ARG . 8.2 p -60.87 -42.47 97.95 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-O 116.288 -1.815 . . . . 21.41 114.068 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.53 ' NE2' ' CH2' ' A' ' 81' ' ' TRP . 26.7 mt-30 -82.36 5.52 20.02 Favored 'General case' 0 C--N 1.291 -1.971 0 C-N-CA 131.652 3.981 . . . . 22.13 114.907 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' B GLY . . . . . . . . . . . . . . . 52.45 45.95 58.53 Favored Glycine 0 C--O 1.254 1.389 1 O-C-N 115.839 -4.288 . . . . 22.1 116.485 -179.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.53 ' CH2' ' NE2' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -48.91 -69.98 0.1 Allowed 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 122.242 3.021 . . . . 23.65 108.333 179.218 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 95.7 mt -38.15 -54.27 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.972 0 O-C-N 126.531 2.395 . . . . 20.37 112.267 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.564 ' N ' ' ND1' ' A' ' 83' ' ' HIS . 0.2 OUTLIER -56.38 -53.73 53.86 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 124.474 1.109 . . . . 28.93 109.247 179.561 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -49.09 -59.48 3.6 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 127.305 2.242 . . . . 27.52 112.56 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.496 ' CZ3' ' HB3' ' A' ' 81' ' ' TRP . 44.9 m0 -56.4 -49.05 75.62 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 127.664 2.386 . . . . 20.1 116.22 177.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -58.54 -31.89 68.37 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.315 0.579 . . . . 23.64 110.865 -176.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -74.58 -37.15 62.99 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 106.608 -1.626 . . . . 19.41 106.608 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -95.26 27.44 3.28 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 125.742 1.901 . . . . 37.2 114.798 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 60.14 24.48 60.97 Favored Glycine 0 C--N 1.291 -1.95 0 C-N-CA 127.151 2.31 . . . . 17.42 115.615 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 72.7 m95 67.54 29.07 7.35 Favored 'General case' 0 C--O 1.255 1.39 0 N-CA-C 116.774 2.138 . . . . 18.31 116.774 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 mtmt -120.23 151.63 38.89 Favored 'General case' 0 C--N 1.311 -1.092 0 O-C-N 120.48 -1.388 . . . . 27.14 107.648 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 62.7 p -80.14 177.82 8.68 Favored 'General case' 0 C--O 1.264 1.849 0 CA-C-O 123.565 1.65 . . . . 23.13 108.335 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.28 -29.68 61.46 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.263 -1.335 . . . . 25.32 112.149 -178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -100.25 29.33 4.38 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.45 -0.5 . . . . 37.74 111.612 -176.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.804 ' HB3' ' O ' ' A' ' 248' ' ' HOH . 2.3 mmtt 57.92 23.95 10.41 Favored 'General case' 0 C--O 1.259 1.599 0 O-C-N 127.854 3.221 . . . . 33.61 117.489 175.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 11.2 mtpt -96.89 154.83 38.15 Favored Pre-proline 0 C--O 1.258 1.546 0 N-CA-C 104.996 -2.224 . . . . 37.83 104.996 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -61.7 137.33 67.9 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 O-C-N 125.726 2.435 . . . . 14.96 108.579 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 85' ' ' TRP . 34.5 m -60.33 155.43 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 CA-C-O 124.774 2.226 . . . . 15.26 107.827 176.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.463 ' HB3' ' HE2' ' A' ' 99' ' ' LYS . 7.2 ttpt -68.52 132.24 46.63 Favored 'General case' 0 C--O 1.261 1.704 0 CA-C-N 112.332 -2.213 . . . . 32.7 107.565 177.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.418 ' ND2' ' HE3' ' A' ' 99' ' ' LYS . 68.8 m-20 58.53 37.99 25.44 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 127.768 2.427 . . . . 16.82 110.85 -177.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.772 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 10.8 p -58.26 -32.11 43.96 Favored 'Isoleucine or valine' 0 C--O 1.254 1.327 0 O-C-N 126.992 2.682 . . . . 15.77 110.011 179.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.434 ' O ' ' HG3' ' A' ' 106' ' ' ARG . 14.0 p-10 -59.97 -45.07 93.9 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 124.979 1.424 . . . . 16.76 112.078 -178.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 49' ' ' LEU . 14.7 mt -73.38 -48.37 34.56 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 127.674 2.389 . . . . 11.87 112.601 -179.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -55.68 -40.03 71.78 Favored 'General case' 0 C--O 1.281 2.732 0 CA-C-O 118.029 -0.986 . . . . 16.34 111.664 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.772 ' HG3' ' O ' ' A' ' 101' ' ' VAL . 68.5 mt-30 -63.79 -45.23 90.63 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.33 1.019 . . . . 19.44 112.027 176.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 102' ' ' ASP . 64.6 mtp180 -61.14 -38.59 86.93 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 126.37 2.294 . . . . 18.19 109.282 -179.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 52.2 tp -64.1 -58.3 7.07 Favored 'General case' 0 C--O 1.269 2.087 0 CA-C-O 116.333 -1.794 . . . . 16.91 111.262 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -43.2 -47.47 6.36 Favored 'General case' 0 C--O 1.255 1.37 0 O-C-N 127.565 3.041 . . . . 22.46 111.824 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -60.7 -36.22 78.27 Favored 'General case' 0 C--N 1.31 -1.145 0 O-C-N 119.775 -1.828 . . . . 21.42 112.326 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.16 -41.69 66.8 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-O 122.631 1.205 . . . . 20.68 112.346 178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.704 HD12 HD12 ' A' ' 116' ' ' ILE . 2.3 mp -59.33 -32.13 69.8 Favored 'General case' 0 C--O 1.254 1.298 0 CA-C-N 113.997 -1.456 . . . . 23.08 114.651 179.6 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -80.06 -7.8 88.2 Favored Glycine 0 N--CA 1.495 2.577 0 N-CA-C 109.097 -1.601 . . . . 23.94 109.097 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -89.54 -48.96 6.96 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.964 0.888 . . . . 33.28 111.606 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 67.8 m-70 -108.7 159.65 16.58 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 124.799 1.24 . . . . 21.35 113.877 -175.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -95.03 110.51 22.42 Favored 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 100.871 -3.752 . . . . 28.41 100.871 177.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.704 HD12 HD12 ' A' ' 111' ' ' LEU . 21.0 mt -109.74 140.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 CA-C-O 123.839 1.781 . . . . 21.78 113.715 -175.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.975 ' HD3' HD13 ' A' ' 66' ' ' ILE . 13.6 tmtt? -124.38 109.04 12.83 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.135 2.574 . . . . 31.37 105.75 179.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -84.04 141.39 31.2 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.276 -1.784 . . . . 20.46 109.859 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.609 ' HB2' HD11 ' A' ' 66' ' ' ILE . 2.5 tt0 -132.09 111.46 11.49 Favored 'General case' 0 C--N 1.307 -1.282 0 N-CA-C 106.586 -1.635 . . . . 35.01 106.586 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 6.1 m95 -93.87 118.89 32.07 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 124.16 1.933 . . . . 20.01 109.826 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.0 m -103.61 153.23 5.98 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 113.258 -1.792 . . . . 22.3 111.08 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.441 ' N ' ' O ' ' A' ' 235' ' ' HOH . 1.2 tptm -139.25 101.86 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.374 -1.285 . . . . 27.94 109.943 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . 96.86 142.94 13.9 Favored Glycine 0 N--CA 1.469 0.86 0 O-C-N 126.618 2.449 . . . . 28.0 111.335 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HIS . . . . . 0.523 ' HB3' ' HG3' ' A' ' 131' ' ' GLU . 45.6 m170 -74.39 -13.2 60.69 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 117.09 -1.434 . . . . 29.64 112.363 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -64.74 106.25 1.16 Allowed 'General case' 0 C--N 1.306 -1.301 0 O-C-N 129.051 3.969 . . . . 27.77 108.306 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 78.14 34.48 37.17 Favored Glycine 0 C--O 1.245 0.79 0 O-C-N 127.929 3.268 . . . . 26.61 110.268 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -148.41 78.63 9.24 Favored Pre-proline 0 C--N 1.315 -0.91 0 O-C-N 127.219 2.364 . . . . 23.58 105.828 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -74.93 -37.27 2.16 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.46 2.107 . . . . 20.75 115.116 -174.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -61.42 -33.36 73.59 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.429 1.081 . . . . 29.34 111.161 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -75.64 -42.15 52.26 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 107.845 -1.169 . . . . 19.22 107.845 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.523 ' HG3' ' HB3' ' A' ' 124' ' ' HIS . 4.8 mt-10 -53.24 -47.88 68.66 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 117.244 -1.782 . . . . 31.98 106.563 177.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -54.6 -48.7 71.86 Favored 'General case' 0 C--O 1.262 1.736 0 O-C-N 126.726 2.516 . . . . 22.24 115.76 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 72.7 m -57.52 -38.49 74.74 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 123.915 0.76 . . . . 17.62 109.274 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -65.34 -43.93 89.38 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 124.175 0.922 . . . . 19.03 109.085 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.25 -39.75 93.88 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.443 1.089 . . . . 32.58 108.945 -179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 16.8 mt -67.18 -44.89 78.55 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 125.11 1.506 . . . . 19.47 110.66 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -61.34 -50.93 70.95 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 126.564 2.415 . . . . 16.95 111.226 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -69.4 -27.06 64.96 Favored 'General case' 0 C--O 1.252 1.235 0 O-C-N 124.656 1.222 . . . . 28.57 111.88 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -72.1 -50.85 24.8 Favored 'General case' 0 C--O 1.263 1.764 0 O-C-N 124.819 1.324 . . . . 20.15 109.406 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -55.19 -46.16 75.85 Favored 'General case' 0 C--O 1.257 1.497 0 N-CA-C 113.201 0.815 . . . . 19.64 113.201 176.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -53.4 -24.95 13.79 Favored 'General case' 0 C--O 1.265 1.875 0 C-N-CA 126.978 2.111 . . . . 19.15 113.58 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 12.4 mmm -79.28 -18.76 52.07 Favored 'General case' 0 N--CA 1.424 -1.754 0 C-N-CA 129.45 3.1 . . . . 39.93 111.318 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . 0.458 ' N ' ' HD3' ' A' ' 144' ' ' PRO . 20.4 m-80 -140.04 67.14 33.58 Favored Pre-proline 0 N--CA 1.494 1.771 0 CA-C-O 124.429 2.061 . . . . 27.92 108.857 -177.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.458 ' HD3' ' N ' ' A' ' 143' ' ' ASN . 2.3 Cg_endo -66.38 132.89 30.69 Favored 'Trans proline' 0 C--O 1.26 1.587 0 CA-C-N 112.84 -1.521 . . . . 21.23 110.707 -175.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.0 p -120.95 -13.87 8.54 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.924 1.39 . . . . 18.17 111.616 178.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 18.2 mt -117.28 160.08 21.66 Favored 'General case' 0 C--N 1.313 -0.99 1 CA-C-O 128.723 4.106 . . . . 18.6 112.982 -178.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 33.1 mp0 -107.41 133.47 51.88 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 110.394 -3.094 . . . . 30.06 103.203 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -97.94 94.61 6.98 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 101.718 -3.438 . . . . 19.02 101.718 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . 0.297 62.8 p -59.99 -38.26 82.05 Favored 'General case' 0 C--O 1.261 1.691 0 O-C-N 126.402 2.314 . . . . 27.03 117.077 -176.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -75.72 -0.59 64.17 Favored Glycine 0 N--CA 1.479 1.538 0 O-C-N 119.201 -2.187 . . . . 30.47 110.719 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -76.79 109.71 10.8 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 117.11 -1.836 . . . . 39.51 108.397 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.581 ' NE2' ' O ' ' A' ' 239' ' ' HOH . 0.0 OUTLIER -94.17 135.68 35.28 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 111.595 -2.548 . . . . 50.07 106.128 178.69 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 243' ' ' HOH . 85.9 t -75.15 -60.66 2.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 O-C-N 128.001 3.313 . . . . 43.54 110.752 -177.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.436 ' HB3' ' H ' ' A' ' 155' ' ' VAL . 2.9 tp10 -25.34 -108.32 0.0 OUTLIER 'General case' 0 N--CA 1.42 -1.926 0 C-N-CA 131.522 3.929 . . . . 53.68 119.391 -176.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.436 ' H ' ' HB3' ' A' ' 154' ' ' GLU . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.167 0 CA-C-O 113.757 -3.02 . . . . 47.12 104.662 179.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.418 ' O ' ' HD3' ' A' ' 33' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 . . . . . 0.617 ' O ' HD22 ' A' ' 26' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.407 ' O ' ' HB3' ' A' ' 44' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 . . . . . 0.404 ' O ' ' HG3' ' A' ' 131' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.441 ' O ' ' N ' ' A' ' 122' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.581 ' O ' ' NE2' ' A' ' 152' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . 0.407 ' O ' ' ND2' ' A' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.599 ' O ' HG13 ' A' ' 153' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.804 ' O ' ' HB3' ' A' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.466 ' O ' ' HA ' ' A' ' 71' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_