data_1god_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 1god _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 83.2 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.66 -0.496 . . . . 35.51 109.66 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . 0.401 ' O ' ' N ' ' A' ' 6' ' ' TRP . 4.7 ptt? -45.64 -42.49 11.45 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.386 0.884 . . . . 41.94 113.386 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -57.45 -38.43 74.45 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.378 -0.601 . . . . 35.68 109.378 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -68.02 -57.01 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.591 -0.892 . . . . 27.43 108.591 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.83 -30.42 33.36 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.998 -0.741 . . . . 18.96 108.998 178.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TRP . . . . . 0.401 ' N ' ' O ' ' A' ' 2' ' ' MET . 7.6 t90 -71.47 -39.58 70.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.731 -1.122 . . . . 62.88 110.361 -179.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -47.4 64.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.596 -1.631 . . . . 41.09 106.596 178.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.2 mtt -48.0 -60.24 2.76 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.11 -0.95 . . . . 25.37 112.238 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 46.9 mt -56.91 -32.05 38.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 115.873 -0.603 . . . . 27.41 111.399 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' A' ' 15' ' ' GLY . 0.0 OUTLIER -65.32 -67.08 0.47 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.778 -0.369 . . . . 29.85 110.702 179.47 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -56.98 -16.84 7.75 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.956 -0.698 . . . . 58.6 112.41 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -84.24 -61.26 1.85 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.418 -0.513 . . . . 40.67 112.37 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.69 -30.32 17.18 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.544 0.572 . . . . 35.56 112.544 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' LEU . . . 88.63 30.21 16.33 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.879 -1.288 . . . . 35.42 109.879 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -133.73 160.76 36.61 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.945 0.72 . . . . 27.93 112.945 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.13 116.04 22.17 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.894 -0.78 . . . . 21.45 108.894 179.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -44.13 -79.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 114.553 1.316 . . . . 22.89 114.553 -178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 1.6 t -38.54 -57.32 1.94 Allowed Pre-proline 0 CA--C 1.518 -0.264 0 N-CA-C 112.689 0.626 . . . . 24.21 112.689 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_exo -51.36 -58.77 1.43 Allowed 'Trans proline' 0 C--O 1.223 -0.256 0 C-N-CA 122.664 2.243 . . . . 22.0 116.538 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -12.86 36.12 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 117.872 2.545 . . . . 22.19 117.872 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -127.28 -33.78 2.35 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.822 0.675 . . . . 20.6 112.822 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.16 -26.55 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 118.027 1.971 . . . . 22.24 118.027 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.88 13.3 5.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.484 0.642 . . . . 32.08 112.29 -178.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 26' ' ' GLY . 9.9 t80 -64.7 148.83 50.27 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 116.047 1.869 . . . . 25.12 116.047 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . 0.544 ' N ' ' CD1' ' A' ' 25' ' ' TYR . . . 40.63 -150.9 0.13 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.621 -1.172 . . . . 20.58 115.524 178.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . 0.404 ' SG ' ' CD ' ' A' ' 38' ' ' LYS . 87.7 m -94.76 -15.43 23.83 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.626 1.713 . . . . 23.79 115.626 -179.103 -70.446 -73.829 -108.969 103.221 2.032 104.649 -69.464 -71.894 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -108.1 -44.42 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.637 1.347 . . . . 32.66 114.637 -178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 59.8 m -44.31 -33.93 1.77 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 116.435 2.013 . . . . 21.14 116.435 -178.311 -55.409 -60.28 89.658 103.14 2.029 103.429 154.116 -67.85 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -50.96 -173.49 0.01 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.271 -0.966 . . . . 25.66 115.425 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.19 88.78 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 108.748 -0.834 . . . . 42.65 108.748 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 106.44 26.82 5.77 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 106.316 -2.714 . . . . 46.48 106.316 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.79 147.85 49.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.336 0.589 . . . . 57.58 111.967 -179.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mtm180 -171.46 146.83 2.3 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.125 -1.065 . . . . 79.94 108.125 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 170.67 -177.55 43.71 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 105.958 -2.857 . . . . 38.76 105.958 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.4 114.92 8.06 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 120.132 -0.627 . . . . 61.42 110.417 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -51.11 135.64 44.91 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.642 2.895 . . . . 34.2 113.632 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . 0.404 ' CD ' ' SG ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -79.38 -18.52 52.19 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.319 -0.863 . . . . 28.55 112.673 -178.944 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.4 p-10 179.4 179.38 0.47 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.846 1.054 . . . . 26.69 113.846 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -34.67 -57.76 0.52 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.226 0.825 . . . . 16.74 113.226 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -47.51 84.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.37 -0.377 . . . . 22.77 111.448 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -54.74 -42.44 71.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.956 -0.387 . . . . 25.51 109.956 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' A' ' 138' ' ' HOH . 3.6 mtm-85 -60.66 -49.64 76.69 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.008 -0.738 . . . . 26.46 109.008 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 145' ' ' HOH . 76.0 m -40.75 -56.41 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 109.287 -0.634 . . . . 19.76 109.287 179.604 -63.578 -68.198 -75.84 103.737 2.026 105.315 -93.358 -166.281 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.14 -45.49 79.59 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.124 -0.489 . . . . 22.63 109.966 -177.715 -67.85 154.116 89.658 103.429 2.029 103.14 -60.28 -55.409 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -53.54 -52.11 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 22.21 110.848 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.54 -38.49 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.981 -0.554 . . . . 24.22 111.151 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -61.2 -20.5 62.84 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.761 -0.775 . . . . 17.94 109.649 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.7 mttt -77.51 -52.52 8.94 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.878 -0.729 . . . . 37.31 111.588 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 73.2 m -56.22 -41.27 75.39 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.27 -0.641 . . . . 29.17 109.27 178.759 -63.063 -66.58 -100.367 104.598 2.029 104.954 -50.247 -95.936 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.2 t -54.43 -49.63 69.54 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.579 -0.282 . . . . 22.73 111.183 178.672 -160.965 -88.551 -83.456 105.609 2.03 104.546 -64.36 -69.574 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . 0.521 ' OH ' ' OD1' ' A' ' 99' ' ' ASP . 1.9 m-30 -61.2 -25.57 67.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.192 0.52 . . . . 30.72 110.56 -179.856 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -72.49 12.38 0.48 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.487 -0.778 . . . . 54.72 111.253 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.67 -31.9 9.65 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.749 -0.38 . . . . 54.62 110.145 179.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.24 93.94 4.05 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.87 110.741 -179.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.3 p -100.56 18.61 18.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.679 -0.691 . . . . 64.73 110.538 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.81 11.07 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.563 0.579 . . . . 73.09 112.563 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.7 p -162.63 134.27 5.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.44 -0.345 . . . . 55.75 110.913 179.414 65.981 -78.206 -80.246 103.281 2.025 101.409 -87.313 -166.08 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -82.77 120.62 76.75 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.09 -0.505 . . . . 50.13 110.445 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.39 -13.19 32.83 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 123.235 2.623 . . . . 44.87 112.631 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -68.25 -63.79 0.99 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.916 0.71 . . . . 66.8 112.916 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.88 -22.94 13.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 117.622 2.452 . . . . 44.4 117.622 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -64.37 124.01 20.67 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.614 -0.513 . . . . 36.19 109.614 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.3 p -100.04 124.97 46.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.38 0.61 . . . . 37.73 111.211 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -95.8 176.94 5.94 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.121 -0.945 . . . . 42.81 108.734 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.8 t -109.44 133.15 53.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.162 0.506 . . . . 64.07 110.986 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -160.67 168.46 24.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.481 -0.782 . . . . 66.25 110.314 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.34 -171.92 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 64.84 110.676 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -128.57 91.08 3.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.641 -0.708 . . . . 89.89 110.986 -179.234 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.36 88.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.108 -0.701 . . . . 89.81 109.108 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.88 81.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.632 0.605 . . . . 92.84 112.632 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 69.84 1.47 3.45 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 114.983 1.475 . . . . 80.38 114.983 179.089 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.0 m -122.83 129.11 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.435 1.272 . . . . 81.14 114.435 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.9 mt -66.98 143.04 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 N-CA-C 107.553 -1.277 . . . . 62.31 107.553 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -150.01 104.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.041 -0.726 . . . . 53.2 109.041 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 93.2 m -63.2 -103.69 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.791 0.663 . . . . 68.77 112.791 -179.167 -68.6 -76.68 -96.506 103.032 2.024 103.359 -84.591 -178.176 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.21 97.5 0.01 OUTLIER Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.922 -0.581 . . . . 70.73 114.197 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -160.83 -163.42 1.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.63 0.604 . . . . 75.62 112.63 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 87' ' ' ASN . 0.5 OUTLIER -77.67 158.01 29.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.311 -0.859 . . . . 74.84 109.564 -179.491 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . 0.452 ' OD1' ' CD ' ' A' ' 89' ' ' PRO . 0.6 OUTLIER 69.34 171.49 0.1 Allowed Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 113.36 -1.746 . . . . 70.75 109.296 -179.18 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' A' ' 90' ' ' CYS . 94.8 Cg_endo -109.19 -49.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.413 0 O-C-N 124.077 1.567 . . . . 63.01 109.504 178.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' CYS . . . . . 0.503 ' N ' ' CD ' ' A' ' 89' ' ' PRO . 13.4 t -54.73 -41.97 71.03 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.418 -0.801 . . . . 62.7 110.533 -178.168 -166.08 -87.313 -80.246 101.409 2.025 103.281 -78.206 65.981 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -31.05 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.127 -0.694 . . . . 56.09 109.127 178.256 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -69.15 -52.54 27.07 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.33 0.493 . . . . 61.19 112.33 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.64 -52.68 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.083 -2.192 . . . . 49.94 105.083 178.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 28.0 ttm -52.92 -54.83 29.0 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.241 -0.89 . . . . 35.87 111.017 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 51.1 t -58.73 -31.84 68.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.319 -0.401 . . . . 39.31 111.475 179.975 -178.176 -84.591 -96.506 103.359 2.024 103.032 -76.68 -68.6 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -77.71 -34.09 52.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.928 0.714 . . . . 45.09 112.928 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 98.8 m -66.04 -51.4 58.55 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.069 -1.826 . . . . 31.64 106.069 178.273 -69.574 -64.36 -83.456 104.546 2.03 105.609 -88.551 -160.965 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . 0.521 ' OD1' ' OH ' ' A' ' 52' ' ' TYR . 85.4 m-20 -50.09 -44.97 52.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.363 -0.835 . . . . 24.8 111.89 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 62.8 tttt -66.99 -31.43 71.99 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.571 -0.451 . . . . 62.05 111.743 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.53 -20.26 58.81 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 116.342 -0.39 . . . . 26.82 110.525 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . 0.577 ' CG2' ' O ' ' A' ' 145' ' ' HOH . 2.2 p -83.57 -47.05 18.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 108.408 -0.96 . . . . 22.74 108.408 179.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' N ' ' CG1' ' A' ' 102' ' ' VAL . . . -60.26 -34.05 73.17 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.748 -0.66 . . . . 21.03 111.391 179.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.0 mt -82.9 -24.46 8.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 110.304 -0.258 . . . . 21.88 110.304 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 13.8 t -73.54 -63.24 1.24 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.732 -0.84 . . . . 26.02 108.732 179.027 -166.281 -93.358 -75.84 105.315 2.026 103.737 -68.198 -63.578 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . 0.492 ' CD2' ' O ' ' A' ' 134' ' ' HOH . 0.3 OUTLIER -48.19 -33.51 8.58 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 114.501 -1.227 . . . . 25.64 107.917 179.355 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . 0.681 ' NH2' ' O ' ' A' ' 183' ' ' HOH . 0.0 OUTLIER -77.9 -35.31 50.86 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.232 -0.894 . . . . 42.64 113.106 -178.793 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -68.67 -20.02 64.42 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.736 -0.786 . . . . 54.25 112.5 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' A' ' 109' ' ' ASN . 0.1 OUTLIER -119.13 44.57 2.3 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.725 -0.79 . . . . 33.2 112.973 179.914 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 mt -65.29 -45.21 85.32 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.382 -1.34 . . . . 26.24 107.382 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.9 p30 -62.63 14.24 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.104 -0.953 . . . . 39.91 113.267 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -131.05 -6.51 3.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.08 0.466 . . . . 31.49 109.826 -178.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -53.55 134.53 40.96 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.915 -1.883 . . . . 24.36 105.915 178.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -124.26 113.61 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.664 0.269 . . . . 35.84 110.837 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.47 -16.98 11.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.199 0.814 . . . . 28.1 113.199 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 15.8 m-20 -79.88 -13.38 59.43 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.988 -0.685 . . . . 40.66 111.12 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 17.3 m-30 -98.19 -23.84 15.52 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 110.399 -0.223 . . . . 31.55 110.399 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -30.24 -47.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.064 1.505 . . . . 40.24 115.064 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 3.5 mm -135.55 78.56 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 102.919 -2.993 . . . . 34.36 102.919 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -82.09 130.51 59.83 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 32.54 112.106 -178.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -40.06 -99.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.501 1 C-N-CA 125.708 4.272 . . . . 37.75 114.543 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . 0.534 ' N ' ' O ' ' A' ' 155' ' ' HOH . 18.0 tttp 168.42 -55.56 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 107.695 -1.224 . . . . 49.04 107.695 178.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -61.23 -7.52 8.46 Favored 'Trans proline' 0 C--N 1.347 0.45 0 N-CA-C 108.637 -1.332 . . . . 31.82 108.637 179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . 0.571 ' CB ' ' O ' ' A' ' 155' ' ' HOH . 1.7 tp -88.73 7.44 33.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.592 -0.731 . . . . 33.93 110.104 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 68.7 m -103.82 -167.54 1.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.131 0.491 . . . . 44.78 111.56 179.975 -71.894 -69.464 -108.969 104.649 2.032 103.221 -73.829 -70.446 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -147.2 -176.67 5.31 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.704 -0.68 . . . . 60.11 110.381 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.17 128.25 35.87 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 62.06 109.96 179.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.58 143.71 54.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 58.72 111.775 179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -69.06 157.45 36.79 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.789 -1.189 . . . . 70.85 107.789 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.4 136.12 36.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.559 -1.274 . . . . 61.17 107.559 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.058 -0.973 . . . . 45.25 108.555 179.751 -95.936 -50.247 -100.367 104.954 2.029 104.598 -66.58 -63.063 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . 0.492 ' O ' ' CD2' ' A' ' 106' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . 0.568 ' O ' ' NH1' ' A' ' 43' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . 0.577 ' O ' ' CG2' ' A' ' 102' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . 0.571 ' O ' ' CB ' ' A' ' 125' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . 0.681 ' O ' ' NH2' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 69' ' ' LYS . 83.2 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.66 -0.496 . . . . 35.51 109.66 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . 0.579 ' HB2' ' O ' ' A' ' 146' ' ' HOH . 4.7 ptt? -45.64 -42.49 11.45 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.386 0.884 . . . . 41.94 113.386 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -57.45 -38.43 74.45 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.378 -0.601 . . . . 35.68 109.378 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -68.02 -57.01 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.591 -0.892 . . . . 27.43 108.591 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.782 HD11 HD11 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -52.83 -30.42 33.36 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.998 -0.741 . . . . 18.96 108.998 178.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TRP . . . . . 0.63 ' HE1' HG23 ' A' ' 19' ' ' VAL . 7.6 t90 -71.47 -39.58 70.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.731 -1.122 . . . . 62.88 110.361 -179.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.33 -47.4 64.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.596 -1.631 . . . . 41.09 106.596 178.422 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.2 mtt -48.0 -60.24 2.76 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.11 -0.95 . . . . 25.37 112.238 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . 0.782 HD11 HD11 ' A' ' 5' ' ' LEU . 46.9 mt -56.91 -32.05 38.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 115.873 -0.603 . . . . 27.41 111.399 179.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' GLY . 0.0 OUTLIER -65.32 -67.08 0.47 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.778 -0.369 . . . . 29.85 110.702 179.47 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 2.3 pt20 -56.98 -16.84 7.75 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.956 -0.698 . . . . 58.6 112.41 -179.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -84.24 -61.26 1.85 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.418 -0.513 . . . . 40.67 112.37 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . 0.464 ' HB ' ' HD3' ' A' ' 16' ' ' LYS . 1.0 OUTLIER -90.69 -30.32 17.18 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.544 0.572 . . . . 35.56 112.544 -179.786 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 10' ' ' LEU . . . 88.63 30.21 16.33 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.879 -1.288 . . . . 35.42 109.879 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HD2' HD21 ' A' ' 110' ' ' LEU . 3.9 mtpp -133.73 160.76 36.61 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.945 0.72 . . . . 27.93 112.945 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASN . . . . . 0.752 ' HB3' ' HG2' ' A' ' 20' ' ' PRO . 0.4 OUTLIER -83.13 116.04 22.17 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.894 -0.78 . . . . 21.45 108.894 179.807 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . . . -44.13 -79.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 114.553 1.316 . . . . 22.89 114.553 -178.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.764 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 1.6 t -38.54 -57.32 1.94 Allowed Pre-proline 0 CA--C 1.518 -0.264 0 N-CA-C 112.689 0.626 . . . . 24.21 112.689 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . 0.764 ' HD3' ' HB ' ' A' ' 19' ' ' VAL . 64.8 Cg_exo -51.36 -58.77 1.43 Allowed 'Trans proline' 0 C--O 1.223 -0.256 0 C-N-CA 122.664 2.243 . . . . 22.0 116.538 179.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -12.86 36.12 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 117.872 2.545 . . . . 22.19 117.872 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . 0.439 ' CE1' ' HG ' ' A' ' 106' ' ' LEU . 58.1 m-85 -127.28 -33.78 2.35 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.822 0.675 . . . . 20.6 112.822 -179.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.16 -26.55 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 118.027 1.971 . . . . 22.24 118.027 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . 0.599 HD23 HG23 ' A' ' 119' ' ' ILE . 0.8 OUTLIER -130.88 13.3 5.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.484 0.642 . . . . 32.08 112.29 -178.917 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 26' ' ' GLY . 9.9 t80 -64.7 148.83 50.27 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 116.047 1.869 . . . . 25.12 116.047 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . 0.544 ' N ' ' CD1' ' A' ' 25' ' ' TYR . . . 40.63 -150.9 0.13 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.621 -1.172 . . . . 20.58 115.524 178.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . 0.882 ' SG ' ' HD3' ' A' ' 38' ' ' LYS . 87.7 m -94.76 -15.43 23.83 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.626 1.713 . . . . 23.79 115.626 -179.103 -70.446 -73.829 -108.969 103.221 2.032 104.649 -69.464 -71.894 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . 0.63 ' OD1' ' HG2' ' A' ' 34' ' ' ARG . 59.4 m-80 -108.1 -44.42 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.637 1.347 . . . . 32.66 114.637 -178.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 25' ' ' TYR . 59.8 m -44.31 -33.93 1.77 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 116.435 2.013 . . . . 21.14 116.435 -178.311 -55.409 -60.28 89.658 103.14 2.029 103.429 154.116 -67.85 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . 0.469 ' HA3' ' OG ' ' A' ' 33' ' ' SER . . . -50.96 -173.49 0.01 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.271 -0.966 . . . . 25.66 115.425 -179.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.19 88.78 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 108.748 -0.834 . . . . 42.65 108.748 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 106.44 26.82 5.77 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 106.316 -2.714 . . . . 46.48 106.316 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . 0.469 ' OG ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -125.79 147.85 49.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.336 0.589 . . . . 57.58 111.967 -179.617 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HG2' ' OD1' ' A' ' 28' ' ' ASN . 2.6 mtm180 -171.46 146.83 2.3 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.125 -1.065 . . . . 79.94 108.125 179.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . 0.596 ' HA2' ' CA ' ' A' ' 130' ' ' ALA . . . 170.67 -177.55 43.71 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 105.958 -2.857 . . . . 38.76 105.958 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.4 114.92 8.06 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 120.132 -0.627 . . . . 61.42 110.417 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -51.11 135.64 44.91 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.642 2.895 . . . . 34.2 113.632 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . 0.882 ' HD3' ' SG ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -79.38 -18.52 52.19 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.319 -0.863 . . . . 28.55 112.673 -178.944 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 38' ' ' LYS . 30.4 p-10 179.4 179.38 0.47 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.846 1.054 . . . . 26.69 113.846 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . 0.675 ' HB1' ' ND2' ' A' ' 109' ' ' ASN . . . -34.67 -57.76 0.52 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.226 0.825 . . . . 16.74 113.226 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -47.51 84.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.37 -0.377 . . . . 22.77 111.448 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . 0.758 ' OD2' ' HG2' ' A' ' 38' ' ' LYS . 24.2 t0 -54.74 -42.44 71.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.956 -0.387 . . . . 25.51 109.956 -179.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' A' ' 138' ' ' HOH . 3.6 mtm-85 -60.66 -49.64 76.69 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.008 -0.738 . . . . 26.46 109.008 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 145' ' ' HOH . 76.0 m -40.75 -56.41 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 109.287 -0.634 . . . . 19.76 109.287 179.604 -63.578 -68.198 -75.84 103.737 2.026 105.315 -93.358 -166.281 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.14 -45.49 79.59 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.124 -0.489 . . . . 22.63 109.966 -177.715 -67.85 154.116 89.658 103.429 2.029 103.14 -60.28 -55.409 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . 0.745 ' HE1' ' O ' ' A' ' 169' ' ' HOH . 20.4 t80 -53.54 -52.11 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 22.21 110.848 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.54 -38.49 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.981 -0.554 . . . . 24.22 111.151 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -61.2 -20.5 62.84 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.761 -0.775 . . . . 17.94 109.649 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . 0.466 ' HD3' ' HE ' ' A' ' 34' ' ' ARG . 32.7 mttt -77.51 -52.52 8.94 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.878 -0.729 . . . . 37.31 111.588 179.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 73.2 m -56.22 -41.27 75.39 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.27 -0.641 . . . . 29.17 109.27 178.759 -63.063 -66.58 -100.367 104.598 2.029 104.954 -50.247 -95.936 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 154' ' ' HOH . 7.2 t -54.43 -49.63 69.54 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.579 -0.282 . . . . 22.73 111.183 178.672 -160.965 -88.551 -83.456 105.609 2.03 104.546 -64.36 -69.574 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . 0.432 ' CE2' ' HB2' ' A' ' 68' ' ' PRO . 1.9 m-30 -61.2 -25.57 67.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.192 0.52 . . . . 30.72 110.56 -179.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -72.49 12.38 0.48 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.487 -0.778 . . . . 54.72 111.253 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.562 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -103.67 -31.9 9.65 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.749 -0.38 . . . . 54.62 110.145 179.753 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.823 HD23 ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -77.24 93.94 4.05 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.87 110.741 -179.484 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.3 p -100.56 18.61 18.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.679 -0.691 . . . . 64.73 110.538 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.81 11.07 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.563 0.579 . . . . 73.09 112.563 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.7 p -162.63 134.27 5.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.44 -0.345 . . . . 55.75 110.913 179.414 65.981 -78.206 -80.246 103.281 2.025 101.409 -87.313 -166.08 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . 0.498 ' O ' ' HB2' ' A' ' 71' ' ' ASP . 0.4 OUTLIER -82.77 120.62 76.75 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.09 -0.505 . . . . 50.13 110.445 179.679 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.489 ' HA ' ' SD ' ' A' ' 95' ' ' MET . 74.0 Cg_endo -70.39 -13.19 32.83 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 123.235 2.623 . . . . 44.87 112.631 -179.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . 0.519 ' HE3' ' HE1' ' A' ' 2' ' ' MET . 6.3 tptt -68.25 -63.79 0.99 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.916 0.71 . . . . 66.8 112.916 -179.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.88 -22.94 13.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 117.622 2.452 . . . . 44.4 117.622 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 67' ' ' SER . 34.9 m-20 -64.37 124.01 20.67 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.614 -0.513 . . . . 36.19 109.614 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.3 p -100.04 124.97 46.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.38 0.61 . . . . 37.73 111.211 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -95.8 176.94 5.94 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.121 -0.945 . . . . 42.81 108.734 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . 0.736 ' HB3' ' CB ' ' A' ' 86' ' ' ASP . 6.8 t -109.44 133.15 53.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.162 0.506 . . . . 64.07 110.986 179.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -160.67 168.46 24.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.481 -0.782 . . . . 66.25 110.314 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.34 -171.92 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 64.84 110.676 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TRP . . . . . 0.471 ' CH2' ' HB2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -128.57 91.08 3.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.641 -0.708 . . . . 89.89 110.986 -179.234 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.36 88.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.108 -0.701 . . . . 89.81 109.108 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.88 81.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.632 0.605 . . . . 92.84 112.632 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . 0.635 ' HB3' ' O ' ' A' ' 177' ' ' HOH . 0.5 OUTLIER 69.84 1.47 3.45 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 114.983 1.475 . . . . 80.38 114.983 179.089 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.0 m -122.83 129.11 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.435 1.272 . . . . 81.14 114.435 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . 0.49 ' O ' ' HE3' ' A' ' 100' ' ' LYS . 2.9 mt -66.98 143.04 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 N-CA-C 107.553 -1.277 . . . . 62.31 107.553 179.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 83' ' ' VAL . 0.1 OUTLIER -150.01 104.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.041 -0.726 . . . . 53.2 109.041 -179.612 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 93.2 m -63.2 -103.69 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.791 0.663 . . . . 68.77 112.791 -179.167 -68.6 -76.68 -96.506 103.032 2.024 103.359 -84.591 -178.176 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.21 97.5 0.01 OUTLIER Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.922 -0.581 . . . . 70.73 114.197 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . 0.736 ' CB ' ' HB3' ' A' ' 74' ' ' SER . 3.9 p-10 -160.83 -163.42 1.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.63 0.604 . . . . 75.62 112.63 -179.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . 0.46 ' N ' ' OD1' ' A' ' 87' ' ' ASN . 0.5 OUTLIER -77.67 158.01 29.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.311 -0.859 . . . . 74.84 109.564 -179.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . 0.498 ' OD1' ' HD2' ' A' ' 89' ' ' PRO . 0.6 OUTLIER 69.34 171.49 0.1 Allowed Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 113.36 -1.746 . . . . 70.75 109.296 -179.18 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . 0.795 ' HD2' ' H ' ' A' ' 90' ' ' CYS . 94.8 Cg_endo -109.19 -49.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.413 0 O-C-N 124.077 1.567 . . . . 63.01 109.504 178.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' CYS . . . . . 0.795 ' H ' ' HD2' ' A' ' 89' ' ' PRO . 13.4 t -54.73 -41.97 71.03 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.418 -0.801 . . . . 62.7 110.533 -178.168 -166.08 -87.313 -80.246 101.409 2.025 103.281 -78.206 65.981 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -31.05 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.127 -0.694 . . . . 56.09 109.127 178.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -69.15 -52.54 27.07 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.33 0.493 . . . . 61.19 112.33 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.823 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.6 OUTLIER -48.64 -52.68 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.083 -2.192 . . . . 49.94 105.083 178.912 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . 0.489 ' SD ' ' HA ' ' A' ' 68' ' ' PRO . 28.0 ttm -52.92 -54.83 29.0 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.241 -0.89 . . . . 35.87 111.017 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 51.1 t -58.73 -31.84 68.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.319 -0.401 . . . . 39.31 111.475 179.975 -178.176 -84.591 -96.506 103.359 2.024 103.032 -76.68 -68.6 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -77.71 -34.09 52.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.928 0.714 . . . . 45.09 112.928 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . 0.658 ' HB3' ' O ' ' A' ' 154' ' ' HOH . 98.8 m -66.04 -51.4 58.55 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.069 -1.826 . . . . 31.64 106.069 178.273 -69.574 -64.36 -83.456 104.546 2.03 105.609 -88.551 -160.965 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . 0.866 ' O ' HG12 ' A' ' 102' ' ' VAL . 85.4 m-20 -50.09 -44.97 52.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.363 -0.835 . . . . 24.8 111.89 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 82' ' ' ILE . 62.8 tttt -66.99 -31.43 71.99 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.571 -0.451 . . . . 62.05 111.743 -179.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.53 -20.26 58.81 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 116.342 -0.39 . . . . 26.82 110.525 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 99' ' ' ASP . 2.2 p -83.57 -47.05 18.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 108.408 -0.96 . . . . 22.74 108.408 179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' N ' ' CG1' ' A' ' 102' ' ' VAL . . . -60.26 -34.05 73.17 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.748 -0.66 . . . . 21.03 111.391 179.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.0 mt -82.9 -24.46 8.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 110.304 -0.258 . . . . 21.88 110.304 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 13.8 t -73.54 -63.24 1.24 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.732 -0.84 . . . . 26.02 108.732 179.027 -166.281 -93.358 -75.84 105.315 2.026 103.737 -68.198 -63.578 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . 0.698 HD21 ' O ' ' A' ' 134' ' ' HOH . 0.3 OUTLIER -48.19 -33.51 8.58 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 114.501 -1.227 . . . . 25.64 107.917 179.355 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.681 ' NH2' ' O ' ' A' ' 183' ' ' HOH . 0.0 OUTLIER -77.9 -35.31 50.86 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.232 -0.894 . . . . 42.64 113.106 -178.793 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -68.67 -20.02 64.42 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.736 -0.786 . . . . 54.25 112.5 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASN . . . . . 0.675 ' ND2' ' HB1' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -119.13 44.57 2.3 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.725 -0.79 . . . . 33.2 112.973 179.914 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . 0.505 HD21 ' HD2' ' A' ' 16' ' ' LYS . 6.2 mt -65.29 -45.21 85.32 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.382 -1.34 . . . . 26.24 107.382 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.9 p30 -62.63 14.24 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.104 -0.953 . . . . 39.91 113.267 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . 0.657 HG21 ' HB3' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -131.05 -6.51 3.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.08 0.466 . . . . 31.49 109.826 -178.928 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . 0.423 ' HD1' ' N ' ' A' ' 114' ' ' ASN . 0.4 OUTLIER -53.55 134.53 40.96 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.915 -1.883 . . . . 24.36 105.915 178.93 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 116' ' ' ASN . 17.6 t-20 -124.26 113.61 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.664 0.269 . . . . 35.84 110.837 -179.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.47 -16.98 11.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.199 0.814 . . . . 28.1 113.199 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASN . . . . . 0.474 ' HB2' ' OD1' ' A' ' 114' ' ' ASN . 15.8 m-20 -79.88 -13.38 59.43 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.988 -0.685 . . . . 40.66 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 17.3 m-30 -98.19 -23.84 15.52 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 110.399 -0.223 . . . . 31.55 110.399 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -30.24 -47.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.064 1.505 . . . . 40.24 115.064 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . 0.599 HG23 HD23 ' A' ' 24' ' ' LEU . 3.5 mm -135.55 78.56 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 102.919 -2.993 . . . . 34.36 102.919 178.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TYR . . . . . 0.523 ' CZ ' HD23 ' A' ' 125' ' ' LEU . 1.3 t80 -82.09 130.51 59.83 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 32.54 112.106 -178.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PRO . . . . . 0.689 ' HG2' HD22 ' A' ' 125' ' ' LEU . 73.1 Cg_exo -40.06 -99.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.501 1 C-N-CA 125.708 4.272 . . . . 37.75 114.543 -179.49 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . 0.724 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 18.0 tttp 168.42 -55.56 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 107.695 -1.224 . . . . 49.04 107.695 178.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.5 Cg_exo -61.23 -7.52 8.46 Favored 'Trans proline' 0 C--N 1.347 0.45 0 N-CA-C 108.637 -1.332 . . . . 31.82 108.637 179.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' A' ' 121' ' ' PRO . 1.7 tp -88.73 7.44 33.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.592 -0.731 . . . . 33.93 110.104 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' CYS . . . . . 0.449 ' C ' ' HG3' ' A' ' 127' ' ' LYS . 68.7 m -103.82 -167.54 1.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.131 0.491 . . . . 44.78 111.56 179.975 -71.894 -69.464 -108.969 104.649 2.032 103.221 -73.829 -70.446 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.449 ' HG3' ' C ' ' A' ' 126' ' ' CYS . 0.1 OUTLIER -147.2 -176.67 5.31 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.704 -0.68 . . . . 60.11 110.381 179.009 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LYS . . . . . 0.601 ' HD3' ' O ' ' A' ' 130' ' ' ALA . 0.4 OUTLIER -60.17 128.25 35.87 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 62.06 109.96 179.707 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . 0.601 ' O ' ' HD3' ' A' ' 129' ' ' LYS . . . -68.58 143.71 54.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 58.72 111.775 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -69.06 157.45 36.79 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.789 -1.189 . . . . 70.85 107.789 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.4 136.12 36.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.559 -1.274 . . . . 61.17 107.559 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.058 -0.973 . . . . 45.25 108.555 179.751 -95.936 -50.247 -100.367 104.954 2.029 104.598 -66.58 -63.063 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . 0.698 ' O ' HD21 ' A' ' 106' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . 0.568 ' O ' ' NH1' ' A' ' 43' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . 0.796 ' O ' HG23 ' A' ' 102' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . 0.579 ' O ' ' HB2' ' A' ' 2' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . 0.658 ' O ' ' HB3' ' A' ' 98' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . 0.571 ' O ' ' CB ' ' A' ' 125' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . 0.745 ' O ' ' HE1' ' A' ' 46' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . 0.635 ' O ' ' HB3' ' A' ' 80' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . 0.681 ' O ' ' NH2' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 69' ' ' LYS . 83.2 p . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.66 -0.496 . . . . 35.51 109.66 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . 0.579 ' HB2' ' O ' ' A' ' 146' ' ' HOH . 4.7 ptt? -45.64 -42.49 11.45 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.386 0.884 . . . . 41.94 113.386 -179.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -57.45 -38.43 74.45 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.378 -0.601 . . . . 35.68 109.378 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 81.3 mt-30 -68.02 -57.01 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.591 -0.892 . . . . 27.43 108.591 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.782 HD11 HD11 ' A' ' 9' ' ' ILE . 1.0 OUTLIER -52.83 -30.42 33.36 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 108.998 -0.741 . . . . 18.96 108.998 178.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.63 ' HE1' HG23 ' A' ' 19' ' ' VAL . 7.6 t90 -71.47 -39.58 70.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.731 -1.122 . . . . 62.88 110.361 -179.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -69.33 -47.4 64.55 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.596 -1.631 . . . . 41.09 106.596 178.422 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.2 mtt -48.0 -60.24 2.76 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.11 -0.95 . . . . 25.37 112.238 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.782 HD11 HD11 ' A' ' 5' ' ' LEU . 46.9 mt -56.91 -32.05 38.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 115.873 -0.603 . . . . 27.41 111.399 179.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.404 ' O ' ' N ' ' A' ' 15' ' ' GLY . 0.0 OUTLIER -65.32 -67.08 0.47 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.778 -0.369 . . . . 29.85 110.702 179.47 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 7' ' ' LYS . 2.3 pt20 -56.98 -16.84 7.75 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.956 -0.698 . . . . 58.6 112.41 -179.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -84.24 -61.26 1.85 Allowed 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.418 -0.513 . . . . 40.67 112.37 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . 0.464 ' HB ' ' HD3' ' A' ' 16' ' ' LYS . 1.0 OUTLIER -90.69 -30.32 17.18 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 112.544 0.572 . . . . 35.56 112.544 -179.786 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 10' ' ' LEU . . . 88.63 30.21 16.33 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.879 -1.288 . . . . 35.42 109.879 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HD2' HD21 ' A' ' 110' ' ' LEU . 3.9 mtpp -133.73 160.76 36.61 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.945 0.72 . . . . 27.93 112.945 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.752 ' HB3' ' HG2' ' A' ' 20' ' ' PRO . 0.4 OUTLIER -83.13 116.04 22.17 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.894 -0.78 . . . . 21.45 108.894 179.807 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.476 ' HB3' ' CD1' ' A' ' 6' ' ' TRP . . . -44.13 -79.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 114.553 1.316 . . . . 22.89 114.553 -178.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.764 ' HB ' ' HD3' ' A' ' 20' ' ' PRO . 1.6 t -38.54 -57.32 1.94 Allowed Pre-proline 0 CA--C 1.518 -0.264 0 N-CA-C 112.689 0.626 . . . . 24.21 112.689 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.764 ' HD3' ' HB ' ' A' ' 19' ' ' VAL . 64.8 Cg_exo -51.36 -58.77 1.43 Allowed 'Trans proline' 0 C--O 1.223 -0.256 0 C-N-CA 122.664 2.243 . . . . 22.0 116.538 179.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -12.86 36.12 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 117.872 2.545 . . . . 22.19 117.872 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.439 ' CE1' ' HG ' ' A' ' 106' ' ' LEU . 58.1 m-85 -127.28 -33.78 2.35 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.822 0.675 . . . . 20.6 112.822 -179.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.16 -26.55 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 118.027 1.971 . . . . 22.24 118.027 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.599 HD23 HG23 ' A' ' 119' ' ' ILE . 0.8 OUTLIER -130.88 13.3 5.28 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 117.484 0.642 . . . . 32.08 112.29 -178.917 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' A' ' 26' ' ' GLY . 9.9 t80 -64.7 148.83 50.27 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 116.047 1.869 . . . . 25.12 116.047 -178.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.544 ' N ' ' CD1' ' A' ' 25' ' ' TYR . . . 40.63 -150.9 0.13 Allowed Glycine 0 N--CA 1.45 -0.43 0 CA-C-N 114.621 -1.172 . . . . 20.58 115.524 178.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.882 ' SG ' ' HD3' ' A' ' 38' ' ' LYS . 87.7 m -94.76 -15.43 23.83 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 115.626 1.713 . . . . 23.79 115.626 -179.103 -70.446 -73.829 -108.969 103.221 2.032 104.649 -69.464 -71.894 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.63 ' OD1' ' HG2' ' A' ' 34' ' ' ARG . 59.4 m-80 -108.1 -44.42 4.17 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.637 1.347 . . . . 32.66 114.637 -178.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 25' ' ' TYR . 59.8 m -44.31 -33.93 1.77 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 116.435 2.013 . . . . 21.14 116.435 -178.311 -55.409 -60.28 89.658 103.14 2.029 103.429 154.116 -67.85 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.469 ' HA3' ' OG ' ' A' ' 33' ' ' SER . . . -50.96 -173.49 0.01 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.271 -0.966 . . . . 25.66 115.425 -179.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -111.19 88.78 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 N-CA-C 108.748 -0.834 . . . . 42.65 108.748 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 106.44 26.82 5.77 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 106.316 -2.714 . . . . 46.48 106.316 -178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . 0.469 ' OG ' ' HA3' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -125.79 147.85 49.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.336 0.589 . . . . 57.58 111.967 -179.617 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.63 ' HG2' ' OD1' ' A' ' 28' ' ' ASN . 2.6 mtm180 -171.46 146.83 2.3 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.125 -1.065 . . . . 79.94 108.125 179.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.596 ' HA2' ' CA ' ' A' ' 130' ' ' ALA . . . 170.67 -177.55 43.71 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 105.958 -2.857 . . . . 38.76 105.958 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.4 114.92 8.06 Favored Pre-proline 0 C--N 1.325 -0.483 0 C-N-CA 120.132 -0.627 . . . . 61.42 110.417 179.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -51.11 135.64 44.91 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.642 2.895 . . . . 34.2 113.632 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.882 ' HD3' ' SG ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -79.38 -18.52 52.19 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.319 -0.863 . . . . 28.55 112.673 -178.944 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 38' ' ' LYS . 30.4 p-10 179.4 179.38 0.47 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.846 1.054 . . . . 26.69 113.846 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.675 ' HB1' ' ND2' ' A' ' 109' ' ' ASN . . . -34.67 -57.76 0.52 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 113.226 0.825 . . . . 16.74 113.226 -179.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -47.51 84.26 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.37 -0.377 . . . . 22.77 111.448 -179.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.758 ' OD2' ' HG2' ' A' ' 38' ' ' LYS . 24.2 t0 -54.74 -42.44 71.62 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.956 -0.387 . . . . 25.51 109.956 -179.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.568 ' NH1' ' O ' ' A' ' 138' ' ' HOH . 3.6 mtm-85 -60.66 -49.64 76.69 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.008 -0.738 . . . . 26.46 109.008 179.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.521 ' C ' ' O ' ' A' ' 145' ' ' HOH . 76.0 m -40.75 -56.41 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 N-CA-C 109.287 -0.634 . . . . 19.76 109.287 179.604 -63.578 -68.198 -75.84 103.737 2.026 105.315 -93.358 -166.281 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.14 -45.49 79.59 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.124 -0.489 . . . . 22.63 109.966 -177.715 -67.85 154.116 89.658 103.429 2.029 103.14 -60.28 -55.409 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.745 ' HE1' ' O ' ' A' ' 169' ' ' HOH . 20.4 t80 -53.54 -52.11 60.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 22.21 110.848 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.54 -38.49 82.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.981 -0.554 . . . . 24.22 111.151 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -61.2 -20.5 62.84 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.761 -0.775 . . . . 17.94 109.649 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.466 ' HD3' ' HE ' ' A' ' 34' ' ' ARG . 32.7 mttt -77.51 -52.52 8.94 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.878 -0.729 . . . . 37.31 111.588 179.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 73.2 m -56.22 -41.27 75.39 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 109.27 -0.641 . . . . 29.17 109.27 178.759 -63.063 -66.58 -100.367 104.598 2.029 104.954 -50.247 -95.936 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 154' ' ' HOH . 7.2 t -54.43 -49.63 69.54 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.579 -0.282 . . . . 22.73 111.183 178.672 -160.965 -88.551 -83.456 105.609 2.03 104.546 -64.36 -69.574 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.432 ' CE2' ' HB2' ' A' ' 68' ' ' PRO . 1.9 m-30 -61.2 -25.57 67.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.192 0.52 . . . . 30.72 110.56 -179.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -72.49 12.38 0.48 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.487 -0.778 . . . . 54.72 111.253 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.562 ' HA ' ' HE3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -103.67 -31.9 9.65 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.749 -0.38 . . . . 54.62 110.145 179.753 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.823 HD23 ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -77.24 93.94 4.05 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.87 110.741 -179.484 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.3 p -100.56 18.61 18.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.679 -0.691 . . . . 64.73 110.538 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.81 11.07 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.563 0.579 . . . . 73.09 112.563 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 29.7 p -162.63 134.27 5.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.44 -0.345 . . . . 55.75 110.913 179.414 65.981 -78.206 -80.246 103.281 2.025 101.409 -87.313 -166.08 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . 0.498 ' O ' ' HB2' ' A' ' 71' ' ' ASP . 0.4 OUTLIER -82.77 120.62 76.75 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.09 -0.505 . . . . 50.13 110.445 179.679 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.489 ' HA ' ' SD ' ' A' ' 95' ' ' MET . 74.0 Cg_endo -70.39 -13.19 32.83 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 123.235 2.623 . . . . 44.87 112.631 -179.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.519 ' HE3' ' HE1' ' A' ' 2' ' ' MET . 6.3 tptt -68.25 -63.79 0.99 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.916 0.71 . . . . 66.8 112.916 -179.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.88 -22.94 13.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 117.622 2.452 . . . . 44.4 117.622 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' A' ' 67' ' ' SER . 34.9 m-20 -64.37 124.01 20.67 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.614 -0.513 . . . . 36.19 109.614 -179.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.3 p -100.04 124.97 46.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.38 0.61 . . . . 37.73 111.211 -179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -95.8 176.94 5.94 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.121 -0.945 . . . . 42.81 108.734 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . 0.736 ' HB3' ' CB ' ' A' ' 86' ' ' ASP . 6.8 t -109.44 133.15 53.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.162 0.506 . . . . 64.07 110.986 179.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -160.67 168.46 24.85 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.481 -0.782 . . . . 66.25 110.314 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.34 -171.92 3.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 64.84 110.676 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.471 ' CH2' ' HB2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -128.57 91.08 3.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.641 -0.708 . . . . 89.89 110.986 -179.234 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.36 88.2 0.87 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.108 -0.701 . . . . 89.81 109.108 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 46.88 81.02 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.632 0.605 . . . . 92.84 112.632 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.635 ' HB3' ' O ' ' A' ' 177' ' ' HOH . 0.5 OUTLIER 69.84 1.47 3.45 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 114.983 1.475 . . . . 80.38 114.983 179.089 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 49.0 m -122.83 129.11 51.28 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 114.435 1.272 . . . . 81.14 114.435 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.49 ' O ' ' HE3' ' A' ' 100' ' ' LYS . 2.9 mt -66.98 143.04 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.275 0 N-CA-C 107.553 -1.277 . . . . 62.31 107.553 179.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 83' ' ' VAL . 0.1 OUTLIER -150.01 104.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.041 -0.726 . . . . 53.2 109.041 -179.612 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 93.2 m -63.2 -103.69 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.791 0.663 . . . . 68.77 112.791 -179.167 -68.6 -76.68 -96.506 103.032 2.024 103.359 -84.591 -178.176 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.21 97.5 0.01 OUTLIER Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.922 -0.581 . . . . 70.73 114.197 179.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.736 ' CB ' ' HB3' ' A' ' 74' ' ' SER . 3.9 p-10 -160.83 -163.42 1.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.63 0.604 . . . . 75.62 112.63 -179.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.46 ' N ' ' OD1' ' A' ' 87' ' ' ASN . 0.5 OUTLIER -77.67 158.01 29.9 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.311 -0.859 . . . . 74.84 109.564 -179.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.498 ' OD1' ' HD2' ' A' ' 89' ' ' PRO . 0.6 OUTLIER 69.34 171.49 0.1 Allowed Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 113.36 -1.746 . . . . 70.75 109.296 -179.18 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.795 ' HD2' ' H ' ' A' ' 90' ' ' CYS . 94.8 Cg_endo -109.19 -49.4 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.413 0 O-C-N 124.077 1.567 . . . . 63.01 109.504 178.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.795 ' H ' ' HD2' ' A' ' 89' ' ' PRO . 13.4 t -54.73 -41.97 71.03 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.418 -0.801 . . . . 62.7 110.533 -178.168 -166.08 -87.313 -80.246 101.409 2.025 103.281 -78.206 65.981 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -31.05 69.21 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.127 -0.694 . . . . 56.09 109.127 178.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -69.15 -52.54 27.07 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 112.33 0.493 . . . . 61.19 112.33 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.823 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.6 OUTLIER -48.64 -52.68 21.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 105.083 -2.192 . . . . 49.94 105.083 178.912 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . 0.489 ' SD ' ' HA ' ' A' ' 68' ' ' PRO . 28.0 ttm -52.92 -54.83 29.0 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.241 -0.89 . . . . 35.87 111.017 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 51.1 t -58.73 -31.84 68.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.319 -0.401 . . . . 39.31 111.475 179.975 -178.176 -84.591 -96.506 103.359 2.024 103.032 -76.68 -68.6 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -77.71 -34.09 52.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.928 0.714 . . . . 45.09 112.928 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . 0.658 ' HB3' ' O ' ' A' ' 154' ' ' HOH . 98.8 m -66.04 -51.4 58.55 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 106.069 -1.826 . . . . 31.64 106.069 178.273 -69.574 -64.36 -83.456 104.546 2.03 105.609 -88.551 -160.965 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.866 ' O ' HG12 ' A' ' 102' ' ' VAL . 85.4 m-20 -50.09 -44.97 52.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.363 -0.835 . . . . 24.8 111.89 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 82' ' ' ILE . 62.8 tttt -66.99 -31.43 71.99 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.571 -0.451 . . . . 62.05 111.743 -179.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.53 -20.26 58.81 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 116.342 -0.39 . . . . 26.82 110.525 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.866 HG12 ' O ' ' A' ' 99' ' ' ASP . 2.2 p -83.57 -47.05 18.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 108.408 -0.96 . . . . 22.74 108.408 179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.483 ' N ' ' CG1' ' A' ' 102' ' ' VAL . . . -60.26 -34.05 73.17 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 115.748 -0.66 . . . . 21.03 111.391 179.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.0 mt -82.9 -24.46 8.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 110.304 -0.258 . . . . 21.88 110.304 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 13.8 t -73.54 -63.24 1.24 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.732 -0.84 . . . . 26.02 108.732 179.027 -166.281 -93.358 -75.84 105.315 2.026 103.737 -68.198 -63.578 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.698 HD21 ' O ' ' A' ' 134' ' ' HOH . 0.3 OUTLIER -48.19 -33.51 8.58 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 114.501 -1.227 . . . . 25.64 107.917 179.355 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.681 ' NH2' ' O ' ' A' ' 183' ' ' HOH . 0.0 OUTLIER -77.9 -35.31 50.86 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.232 -0.894 . . . . 42.64 113.106 -178.793 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -68.67 -20.02 64.42 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.736 -0.786 . . . . 54.25 112.5 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASN . . . . . 0.675 ' ND2' ' HB1' ' A' ' 40' ' ' ALA . 0.1 OUTLIER -119.13 44.57 2.3 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.725 -0.79 . . . . 33.2 112.973 179.914 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.505 HD21 ' HD2' ' A' ' 16' ' ' LYS . 6.2 mt -65.29 -45.21 85.32 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.382 -1.34 . . . . 26.24 107.382 179.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 16.9 p30 -62.63 14.24 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.104 -0.953 . . . . 39.91 113.267 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . 0.657 HG21 ' HB3' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -131.05 -6.51 3.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.08 0.466 . . . . 31.49 109.826 -178.928 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.423 ' HD1' ' N ' ' A' ' 114' ' ' ASN . 0.4 OUTLIER -53.55 134.53 40.96 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.915 -1.883 . . . . 24.36 105.915 178.93 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.748 HD21 ' HB2' ' A' ' 116' ' ' ASN . 47.9 t30 -124.26 113.61 18.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.664 0.269 . . . . 35.84 110.837 -179.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.47 -16.98 11.04 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 113.199 0.814 . . . . 28.1 113.199 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.748 ' HB2' HD21 ' A' ' 114' ' ' ASN . 15.8 m-20 -79.88 -13.38 59.43 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.988 -0.685 . . . . 40.66 111.12 179.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 17.3 m-30 -98.19 -23.84 15.52 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 110.399 -0.223 . . . . 31.55 110.399 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -30.24 -47.86 0.09 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.064 1.505 . . . . 40.24 115.064 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.599 HG23 HD23 ' A' ' 24' ' ' LEU . 3.5 mm -135.55 78.56 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 102.919 -2.993 . . . . 34.36 102.919 178.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TYR . . . . . 0.523 ' CZ ' HD23 ' A' ' 125' ' ' LEU . 1.3 t80 -82.09 130.51 59.83 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.358 -0.837 . . . . 32.54 112.106 -178.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.689 ' HG2' HD22 ' A' ' 125' ' ' LEU . 73.1 Cg_exo -40.06 -99.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.501 1 C-N-CA 125.708 4.272 . . . . 37.75 114.543 -179.49 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.724 ' HB3' ' HD3' ' A' ' 123' ' ' PRO . 18.0 tttp 168.42 -55.56 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 107.695 -1.224 . . . . 49.04 107.695 178.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 122' ' ' LYS . 34.5 Cg_exo -61.23 -7.52 8.46 Favored 'Trans proline' 0 C--N 1.347 0.45 0 N-CA-C 108.637 -1.332 . . . . 31.82 108.637 179.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.689 HD22 ' HG2' ' A' ' 121' ' ' PRO . 1.7 tp -88.73 7.44 33.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.592 -0.731 . . . . 33.93 110.104 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' CYS . . . . . 0.449 ' C ' ' HG3' ' A' ' 127' ' ' LYS . 68.7 m -103.82 -167.54 1.38 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.131 0.491 . . . . 44.78 111.56 179.975 -71.894 -69.464 -108.969 104.649 2.032 103.221 -73.829 -70.446 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.449 ' HG3' ' C ' ' A' ' 126' ' ' CYS . 0.1 OUTLIER -147.2 -176.67 5.31 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.704 -0.68 . . . . 60.11 110.381 179.009 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.601 ' HD3' ' O ' ' A' ' 130' ' ' ALA . 0.4 OUTLIER -60.17 128.25 35.87 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.278 0.631 . . . . 62.06 109.96 179.707 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.601 ' O ' ' HD3' ' A' ' 129' ' ' LYS . . . -68.58 143.71 54.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.845 -0.616 . . . . 58.72 111.775 179.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -69.06 157.45 36.79 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.789 -1.189 . . . . 70.85 107.789 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -79.4 136.12 36.88 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 107.559 -1.274 . . . . 61.17 107.559 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.058 -0.973 . . . . 45.25 108.555 179.751 -95.936 -50.247 -100.367 104.954 2.029 104.598 -66.58 -63.063 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . 0.698 ' O ' HD21 ' A' ' 106' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . 0.568 ' O ' ' NH1' ' A' ' 43' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . 0.796 ' O ' HG23 ' A' ' 102' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . 0.579 ' O ' ' HB2' ' A' ' 2' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . 0.658 ' O ' ' HB3' ' A' ' 98' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . 0.571 ' O ' ' CB ' ' A' ' 125' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . 0.745 ' O ' ' HE1' ' A' ' 46' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . 0.635 ' O ' ' HB3' ' A' ' 80' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . 0.681 ' O ' ' NH2' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_