data_3m9a_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 3m9a _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 ' 6' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 N-CA-C 113.343 0.868 . . . . 125.17 113.343 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -139.02 129.69 26.03 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.037 0.754 . . . . 106.83 113.037 -172.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.7 m -88.12 146.88 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.17 0.51 . . . . 119.31 111.393 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.6 tp -130.62 131.51 44.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.335 -0.848 . . . . 95.81 110.156 -169.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -93.05 114.21 26.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.931 -0.577 . . . . 98.57 109.886 174.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 88.2 mt -70.58 -24.36 25.23 Favored 'Isoleucine or valine' 0 C--O 1.245 0.835 0 N-CA-C 112.969 0.729 . . . . 84.18 112.969 -173.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.51 -44.47 74.58 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.064 0.765 . . . . 87.17 113.064 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.17 -46.88 87.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.817 0.303 . . . . 91.39 111.817 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 61.7 mt -55.34 -58.38 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 65.09 110.429 178.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.25 -45.14 61.9 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.387 0.514 . . . . 61.71 112.387 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -53.0 -45.83 68.05 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.106 0.78 . . . . 78.46 113.106 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -65.24 -48.38 73.5 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.847 0.356 . . . . 69.29 111.389 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.47 -42.61 88.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 CA-C-N 116.027 -0.533 . . . . 47.29 111.912 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.75 -18.74 47.01 Favored Glycine 0 C--N 1.337 0.615 0 O-C-N 123.604 0.565 . . . . 52.99 114.228 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -99.49 21.18 12.55 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.68 0.622 . . . . 61.72 112.68 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -151.87 102.06 2.8 Favored 'General case' 0 C--O 1.246 0.872 0 N-CA-C 108.958 -0.756 . . . . 51.38 108.958 -171.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -51.94 -43.51 63.51 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 113.863 1.06 . . . . 60.52 113.863 -171.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.1 t -69.37 -53.57 18.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.453 -0.339 . . . . 47.7 110.627 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -49.84 -49.37 49.38 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 109.286 -0.635 . . . . 42.4 109.286 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.17 -51.91 67.75 Favored 'General case' 0 C--O 1.221 -0.444 0 O-C-N 124.175 0.922 . . . . 55.94 112.396 -174.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . 0.502 ' NE2' ' O ' ' A' ' 121' ' ' HOH . 11.4 mt-30 -67.95 -34.29 76.29 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.691 1.367 . . . . 59.42 114.691 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -61.32 -39.86 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 N-CA-C 108.746 -0.835 . . . . 43.41 108.746 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 tp -68.81 -44.65 73.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.921 -0.582 . . . . 49.22 111.834 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.0 mmt -77.53 -24.39 49.98 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 115.634 -0.712 . . . . 56.94 111.178 -172.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.49 -37.0 46.98 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 121.023 -0.271 . . . . 51.25 111.052 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -70.15 -14.18 62.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 114.819 1.415 . . . . 54.34 114.819 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.2 mm -93.01 123.7 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 123.375 0.422 . . . . 61.16 110.764 174.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -88.54 -176.31 5.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.478 1.288 . . . . 73.1 114.478 -171.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.46 -35.99 63.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.489 0.922 . . . . 99.22 113.489 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -94.95 10.99 33.43 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.585 1.698 . . . . 99.8 115.585 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 87.99 -2.01 85.3 Favored Glycine 0 N--CA 1.462 0.396 0 N-CA-C 114.635 0.614 . . . . 79.4 114.635 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.4 138.97 31.37 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.907 0.483 . . . . 98.69 111.393 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.79 142.48 57.35 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 123.45 0.469 . . . . 68.6 110.025 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -135.52 165.26 25.92 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.059 -0.519 . . . . 63.14 111.116 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.8 ttm -87.28 143.19 27.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.923 1.289 . . . . 74.01 111.031 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.3 mt -148.09 139.54 23.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 52.39 111.209 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -79.5 162.52 25.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 120.271 -0.572 . . . . 58.18 110.107 165.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -50.93 -39.42 54.71 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.968 1.47 . . . . 47.8 114.968 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 m -66.63 -43.46 84.63 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 122.645 0.378 . . . . 61.2 111.885 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -52.02 -50.29 61.7 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.488 0.493 . . . . 53.62 110.113 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.14 -51.44 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.432 -0.349 . . . . 48.61 110.658 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.61 -32.09 72.2 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.43 0.53 . . . . 55.94 112.43 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -74.2 -39.28 63.25 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.535 -0.302 . . . . 71.89 110.44 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.84 -40.29 91.59 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.709 1.204 . . . . 60.37 114.226 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.3 pt -106.15 149.06 9.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 C-N-CA 120.176 -0.609 . . . . 56.91 109.969 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLN . . . . . 0.702 ' CA ' ' OE1' ' A' ' 51' ' ' GLN 0.369 0.0 OUTLIER -90.22 64.33 6.03 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 117.392 2.367 . . . . 74.99 117.392 -176.446 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.8 mt -133.89 158.26 43.9 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 113.071 -1.877 . . . . 57.97 107.421 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.0 p -66.63 153.28 43.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.589 . . . . 60.33 112.081 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -50.38 -53.14 48.22 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.775 0.657 . . . . 67.98 112.775 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -50.29 -48.25 20.8 Favored 'Trans proline' 0 C--N 1.355 0.882 0 O-C-N 122.568 0.773 . . . . 58.25 113.885 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 96.4 m -58.94 -55.79 30.54 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.497 0.665 . . . . 50.4 111.558 177.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.3 t -61.66 -45.02 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 112.978 0.733 . . . . 42.72 112.978 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -62.63 -46.86 86.29 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 117.503 0.138 . . . . 49.96 111.303 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.77 82.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.916 0.389 . . . . 39.39 111.561 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 37.2 m -65.63 -46.35 79.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.453 -0.794 . . . . 37.62 111.077 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.2 t -55.83 -51.76 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.268 0.627 . . . . 38.39 110.728 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -53.07 -51.68 61.04 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.072 0.767 . . . . 41.24 113.072 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.3 m -64.53 -38.66 91.77 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 119.894 -0.723 . . . . 41.19 112.353 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -63.52 -32.07 73.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.474 1.287 . . . . 43.71 114.474 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -69.89 -36.9 75.82 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 120.69 -0.404 . . . . 48.7 111.704 168.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.8 m -61.53 -47.68 84.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.681 0.277 . . . . 48.46 110.708 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.58 -20.32 64.59 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.267 1.027 . . . . 51.87 112.37 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.51 57.66 Favored Glycine 0 N--CA 1.465 0.578 0 CA-C-O 120.21 -0.217 . . . . 51.26 112.702 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -84.71 -32.44 23.53 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.596 0.198 . . . . 53.74 111.519 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 1.4 pt -122.34 150.77 25.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 O-C-N 123.426 0.454 . . . . 45.9 110.435 173.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -98.98 152.27 19.99 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.302 0.573 . . . . 55.11 111.301 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -117.0 136.13 53.17 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 107.218 -1.401 . . . . 54.06 107.218 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.45 134.41 30.69 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.393 -0.923 . . . . 59.21 109.687 174.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -74.35 138.84 43.72 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.793 -0.817 . . . . 61.34 108.793 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.29 119.39 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 105.519 -2.03 . . . . 65.35 105.519 -168.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.09 -135.18 43.15 Favored Glycine 0 N--CA 1.473 1.131 0 N-CA-C 106.76 -2.536 . . . . 72.48 106.76 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.28 19.71 19.55 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.662 0.731 . . . . 90.66 111.112 167.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.36 -167.08 1.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.18 -0.918 . . . . 63.59 112.216 170.68 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -126.53 154.35 43.95 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.214 -0.903 . . . . 55.24 110.751 -171.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 pt -132.88 152.68 36.54 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 CA-C-O 121.95 0.881 . . . . 62.71 113.306 170.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -117.09 135.2 53.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.537 -1.665 . . . . 51.48 111.747 -172.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 38.8 p -134.55 155.16 50.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.355 -1.72 . . . . 57.11 106.355 173.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.68 138.33 57.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.6 -0.889 . . . . 57.87 108.6 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 79.6 p -74.65 178.91 5.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.75 -0.833 . . . . 61.35 108.75 168.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -62.54 -34.58 77.2 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 82.7 110.097 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 tp -63.14 -44.41 95.64 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.316 -0.856 . . . . 64.69 109.773 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.25 -52.24 52.7 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.568 -0.742 . . . . 55.86 111.359 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 66.0 t -56.79 -41.47 75.48 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.284 0.475 . . . . 68.83 112.284 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.3 -40.76 96.59 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.82 0.674 . . . . 89.57 112.82 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.64 -47.45 92.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.187 0.595 . . . . 62.43 111.779 173.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.43 -36.57 41.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 N-CA-C 112.679 0.622 . . . . 66.82 112.679 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -61.69 -36.46 80.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.511 1.3 . . . . 90.69 114.511 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 36.5 m -62.71 -40.01 95.83 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.905 -0.405 . . . . 78.94 109.905 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -67.93 -46.81 70.48 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.811 1.041 . . . . 76.37 113.811 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -52.89 -39.04 62.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.683 -0.689 . . . . 89.8 111.794 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -69.14 -39.01 79.1 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.908 0.707 . . . . 109.92 112.908 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -55.51 -53.73 52.7 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.458 0.474 . . . . 95.57 109.735 171.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 113.359 0.874 . . . . 100.1 113.359 -177.193 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . 0.502 ' O ' ' NE2' ' A' ' 26' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 N-CA-C 113.343 0.868 . . . . 125.17 113.343 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -139.02 129.69 26.03 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.037 0.754 . . . . 106.83 113.037 -172.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.7 m -88.12 146.88 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.17 0.51 . . . . 119.31 111.393 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.426 ' HG ' HD11 ' A' ' 14' ' ' ILE . 4.6 tp -130.62 131.51 44.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.335 -0.848 . . . . 95.810000000000002 110.156 -169.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -93.05 114.21 26.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.931 -0.577 . . . . 98.569999999999993 109.886 174.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 88.2 mt -70.58 -24.36 25.23 Favored 'Isoleucine or valine' 0 C--O 1.245 0.835 0 N-CA-C 112.969 0.729 . . . . 84.180000000000007 112.969 -173.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.51 -44.47 74.58 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.064 0.765 . . . . 87.170000000000002 113.064 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.17 -46.88 87.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.817 0.303 . . . . 91.390000000000001 111.817 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . 0.426 HD11 ' HG ' ' A' ' 9' ' ' LEU . 61.7 mt -55.34 -58.38 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 65.090000000000003 110.429 178.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.25 -45.14 61.9 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.387 0.514 . . . . 61.710000000000001 112.387 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -53.0 -45.83 68.05 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.106 0.78 . . . . 78.459999999999994 113.106 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -65.24 -48.38 73.5 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.847 0.356 . . . . 69.290000000000006 111.389 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.47 -42.61 88.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 CA-C-N 116.027 -0.533 . . . . 47.289999999999999 111.912 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.75 -18.74 47.01 Favored Glycine 0 C--N 1.337 0.615 0 O-C-N 123.604 0.565 . . . . 52.990000000000002 114.228 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -99.49 21.18 12.55 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.68 0.622 . . . . 61.719999999999999 112.68 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -151.87 102.06 2.8 Favored 'General case' 0 C--O 1.246 0.872 0 N-CA-C 108.958 -0.756 . . . . 51.380000000000003 108.958 -171.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -51.94 -43.51 63.51 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 113.863 1.06 . . . . 60.520000000000003 113.863 -171.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . 0.485 ' SG ' HG22 ' A' ' 56' ' ' THR . 53.1 t -69.37 -53.57 18.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.453 -0.339 . . . . 47.700000000000003 110.627 -174.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . 0.406 ' HB1' ' HZ ' ' A' ' 64' ' ' PHE . . . -49.84 -49.37 49.38 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 109.286 -0.635 . . . . 42.399999999999999 109.286 177.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.17 -51.91 67.75 Favored 'General case' 0 C--O 1.221 -0.444 0 O-C-N 124.175 0.922 . . . . 55.939999999999998 112.396 -174.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 121' ' ' HOH . 11.4 mt-30 -67.95 -34.29 76.29 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.691 1.367 . . . . 59.420000000000002 114.691 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -61.32 -39.86 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 N-CA-C 108.746 -0.835 . . . . 43.409999999999997 108.746 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 tp -68.81 -44.65 73.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.921 -0.582 . . . . 49.219999999999999 111.834 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.0 mmt -77.53 -24.39 49.98 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 115.634 -0.712 . . . . 56.939999999999998 111.178 -172.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.49 -37.0 46.98 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 121.023 -0.271 . . . . 51.25 111.052 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 95.0 m-85 -70.15 -14.18 62.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 114.819 1.415 . . . . 54.340000000000003 114.819 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.2 mm -93.01 123.7 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 123.375 0.422 . . . . 61.159999999999997 110.764 174.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -88.54 -176.31 5.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.478 1.288 . . . . 73.099999999999994 114.478 -171.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.46 -35.99 63.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.489 0.922 . . . . 99.219999999999999 113.489 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -94.95 10.99 33.43 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.585 1.698 . . . . 99.799999999999997 115.585 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 87.99 -2.01 85.3 Favored Glycine 0 N--CA 1.462 0.396 0 N-CA-C 114.635 0.614 . . . . 79.400000000000006 114.635 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.4 138.97 31.37 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.907 0.483 . . . . 98.689999999999998 111.393 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.79 142.48 57.35 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 123.45 0.469 . . . . 68.599999999999994 110.025 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 31' ' ' PHE . 29.7 pt20 -135.52 165.26 25.92 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.059 -0.519 . . . . 63.140000000000001 111.116 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.8 ttm -87.28 143.19 27.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.923 1.289 . . . . 74.010000000000005 111.031 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.3 mt -148.09 139.54 23.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 52.390000000000001 111.209 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -79.5 162.52 25.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 120.271 -0.572 . . . . 58.18 110.107 165.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -50.93 -39.42 54.71 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.968 1.47 . . . . 47.799999999999997 114.968 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 m -66.63 -43.46 84.63 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 122.645 0.378 . . . . 61.200000000000003 111.885 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -52.02 -50.29 61.7 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.488 0.493 . . . . 53.619999999999997 110.113 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.14 -51.44 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.432 -0.349 . . . . 48.609999999999999 110.658 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.61 -32.09 72.2 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.43 0.53 . . . . 55.939999999999998 112.43 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -74.2 -39.28 63.25 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.535 -0.302 . . . . 71.890000000000001 110.44 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.84 -40.29 91.59 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.709 1.204 . . . . 60.369999999999997 114.226 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . 0.406 HG21 ' HB3' ' A' ' 26' ' ' GLN . 4.3 pt -106.15 149.06 9.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 C-N-CA 120.176 -0.609 . . . . 56.909999999999997 109.969 179.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLN . . . . . 1.043 ' HA ' ' OE1' ' A' ' 51' ' ' GLN 0.369 0.0 OUTLIER -90.22 64.33 6.03 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 117.392 2.367 . . . . 74.989999999999995 117.392 -176.446 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.8 mt -133.89 158.26 43.9 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 113.071 -1.877 . . . . 57.969999999999999 107.421 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.0 p -66.63 153.28 43.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.589 . . . . 60.329999999999998 112.081 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -50.38 -53.14 48.22 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.775 0.657 . . . . 67.980000000000004 112.775 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -50.29 -48.25 20.8 Favored 'Trans proline' 0 C--N 1.355 0.882 0 O-C-N 122.568 0.773 . . . . 58.25 113.885 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . 0.485 HG22 ' SG ' ' A' ' 23' ' ' CYS . 96.4 m -58.94 -55.79 30.54 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.497 0.665 . . . . 50.399999999999999 111.558 177.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.3 t -61.66 -45.02 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 112.978 0.733 . . . . 42.719999999999999 112.978 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -62.63 -46.86 86.29 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 117.503 0.138 . . . . 49.960000000000001 111.303 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.77 82.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.916 0.389 . . . . 39.390000000000001 111.561 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 37.2 m -65.63 -46.35 79.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.453 -0.794 . . . . 37.619999999999997 111.077 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.2 t -55.83 -51.76 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.268 0.627 . . . . 38.390000000000001 110.728 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -53.07 -51.68 61.04 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.072 0.767 . . . . 41.240000000000002 113.072 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.3 m -64.53 -38.66 91.77 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 119.894 -0.723 . . . . 41.189999999999998 112.353 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . 0.406 ' HZ ' ' HB1' ' A' ' 24' ' ' ALA . 7.0 m-30 -63.52 -32.07 73.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.474 1.287 . . . . 43.710000000000001 114.474 176.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -69.89 -36.9 75.82 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 120.69 -0.404 . . . . 48.700000000000003 111.704 168.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.8 m -61.53 -47.68 84.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.681 0.277 . . . . 48.460000000000001 110.708 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.58 -20.32 64.59 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.267 1.027 . . . . 51.869999999999997 112.37 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.51 57.66 Favored Glycine 0 N--CA 1.465 0.578 0 CA-C-O 120.21 -0.217 . . . . 51.259999999999998 112.702 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -84.71 -32.44 23.53 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.596 0.198 . . . . 53.740000000000002 111.519 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 1.4 pt -122.34 150.77 25.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 O-C-N 123.426 0.454 . . . . 45.899999999999999 110.435 173.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 81' ' ' TYR . 77.9 m-20 -98.98 152.27 19.99 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.302 0.573 . . . . 55.109999999999999 111.301 177.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -117.0 136.13 53.17 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 107.218 -1.401 . . . . 54.060000000000002 107.218 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 119' ' ' HOH . 0.9 OUTLIER -140.45 134.41 30.69 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.393 -0.923 . . . . 59.210000000000001 109.687 174.924 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -74.35 138.84 43.72 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.793 -0.817 . . . . 61.340000000000003 108.793 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.29 119.39 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 105.519 -2.03 . . . . 65.349999999999994 105.519 -168.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.09 -135.18 43.15 Favored Glycine 0 N--CA 1.473 1.131 0 N-CA-C 106.76 -2.536 . . . . 72.480000000000004 106.76 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.28 19.71 19.55 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.662 0.731 . . . . 90.659999999999997 111.112 167.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.36 -167.08 1.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.18 -0.918 . . . . 63.590000000000003 112.216 170.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -126.53 154.35 43.95 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.214 -0.903 . . . . 55.240000000000002 110.751 -171.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.505 HG13 HG23 ' A' ' 73' ' ' THR . 4.3 pt -132.88 152.68 36.54 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 CA-C-O 121.95 0.881 . . . . 62.710000000000001 113.306 170.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 71' ' ' ASP . 78.2 m-85 -117.09 135.2 53.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.537 -1.665 . . . . 51.479999999999997 111.747 -172.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 38.8 p -134.55 155.16 50.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.355 -1.72 . . . . 57.109999999999999 106.355 173.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.68 138.33 57.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.6 -0.889 . . . . 57.869999999999997 108.6 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 79.6 p -74.65 178.91 5.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.75 -0.833 . . . . 61.350000000000001 108.75 168.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -62.54 -34.58 77.2 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 82.700000000000003 110.097 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 tp -63.14 -44.41 95.64 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.316 -0.856 . . . . 64.689999999999998 109.773 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.25 -52.24 52.7 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.568 -0.742 . . . . 55.859999999999999 111.359 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 66.0 t -56.79 -41.47 75.48 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.284 0.475 . . . . 68.829999999999998 112.284 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.3 -40.76 96.59 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.82 0.674 . . . . 89.569999999999993 112.82 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.64 -47.45 92.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.187 0.595 . . . . 62.43 111.779 173.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.43 -36.57 41.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 N-CA-C 112.679 0.622 . . . . 66.819999999999993 112.679 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 96' ' ' GLN . 25.0 mm-40 -61.69 -36.46 80.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.511 1.3 . . . . 90.689999999999998 114.511 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 36.5 m -62.71 -40.01 95.83 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.905 -0.405 . . . . 78.939999999999998 109.905 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -67.93 -46.81 70.48 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.811 1.041 . . . . 76.370000000000005 113.811 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -52.89 -39.04 62.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.683 -0.689 . . . . 89.799999999999997 111.794 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 42.6 mt-30 -69.14 -39.01 79.1 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.908 0.707 . . . . 109.92 112.908 179.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -55.51 -53.73 52.7 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.458 0.474 . . . . 95.569999999999993 109.735 171.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 113.359 0.874 . . . . 100.09999999999999 113.359 -177.193 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . 0.535 ' O ' HG22 ' A' ' 73' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . 0.447 ' O ' ' NE2' ' A' ' 26' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 N-CA-C 113.343 0.868 . . . . 125.17 113.343 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -139.02 129.69 26.03 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 113.037 0.754 . . . . 106.83 113.037 -172.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.7 m -88.12 146.88 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.17 0.51 . . . . 119.31 111.393 -178.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.426 ' HG ' HD11 ' A' ' 14' ' ' ILE . 4.6 tp -130.62 131.51 44.97 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.335 -0.848 . . . . 95.810000000000002 110.156 -169.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -93.05 114.21 26.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.931 -0.577 . . . . 98.569999999999993 109.886 174.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 88.2 mt -70.58 -24.36 25.23 Favored 'Isoleucine or valine' 0 C--O 1.245 0.835 0 N-CA-C 112.969 0.729 . . . . 84.180000000000007 112.969 -173.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.51 -44.47 74.58 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.064 0.765 . . . . 87.170000000000002 113.064 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -59.17 -46.88 87.25 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 111.817 0.303 . . . . 91.390000000000001 111.817 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.426 HD11 ' HG ' ' A' ' 9' ' ' LEU . 61.7 mt -55.34 -58.38 4.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 65.090000000000003 110.429 178.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.25 -45.14 61.9 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 112.387 0.514 . . . . 61.710000000000001 112.387 175.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -53.0 -45.83 68.05 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.106 0.78 . . . . 78.459999999999994 113.106 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.0 mtt180 -65.24 -48.38 73.5 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.847 0.356 . . . . 69.290000000000006 111.389 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.47 -42.61 88.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 CA-C-N 116.027 -0.533 . . . . 47.289999999999999 111.912 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -59.75 -18.74 47.01 Favored Glycine 0 C--N 1.337 0.615 0 O-C-N 123.604 0.565 . . . . 52.990000000000002 114.228 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 66.2 m-20 -99.49 21.18 12.55 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 112.68 0.622 . . . . 61.719999999999999 112.68 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -151.87 102.06 2.8 Favored 'General case' 0 C--O 1.246 0.872 0 N-CA-C 108.958 -0.756 . . . . 51.380000000000003 108.958 -171.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -51.94 -43.51 63.51 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 113.863 1.06 . . . . 60.520000000000003 113.863 -171.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.485 ' SG ' HG22 ' A' ' 56' ' ' THR . 53.1 t -69.37 -53.57 18.84 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.453 -0.339 . . . . 47.700000000000003 110.627 -174.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.406 ' HB1' ' HZ ' ' A' ' 64' ' ' PHE . . . -49.84 -49.37 49.38 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 109.286 -0.635 . . . . 42.399999999999999 109.286 177.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -58.17 -51.91 67.75 Favored 'General case' 0 C--O 1.221 -0.444 0 O-C-N 124.175 0.922 . . . . 55.939999999999998 112.396 -174.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.447 ' NE2' ' O ' ' A' ' 121' ' ' HOH . 11.4 mt-30 -67.95 -34.29 76.29 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 114.691 1.367 . . . . 59.420000000000002 114.691 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -61.32 -39.86 84.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.259 0 N-CA-C 108.746 -0.835 . . . . 43.409999999999997 108.746 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.2 tp -68.81 -44.65 73.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.921 -0.582 . . . . 49.219999999999999 111.834 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.0 mmt -77.53 -24.39 49.98 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 115.634 -0.712 . . . . 56.939999999999998 111.178 -172.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.49 -37.0 46.98 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 121.023 -0.271 . . . . 51.25 111.052 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 95.0 m-85 -70.15 -14.18 62.53 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 114.819 1.415 . . . . 54.340000000000003 114.819 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.2 mm -93.01 123.7 45.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 123.375 0.422 . . . . 61.159999999999997 110.764 174.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -88.54 -176.31 5.25 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.478 1.288 . . . . 73.099999999999994 114.478 -171.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -54.46 -35.99 63.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 113.489 0.922 . . . . 99.219999999999999 113.489 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -94.95 10.99 33.43 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.585 1.698 . . . . 99.799999999999997 115.585 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 87.99 -2.01 85.3 Favored Glycine 0 N--CA 1.462 0.396 0 N-CA-C 114.635 0.614 . . . . 79.400000000000006 114.635 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -86.4 138.97 31.37 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 122.907 0.483 . . . . 98.689999999999998 111.393 -176.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.79 142.48 57.35 Favored 'General case' 0 C--O 1.24 0.579 0 O-C-N 123.45 0.469 . . . . 68.599999999999994 110.025 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 31' ' ' PHE . 29.7 pt20 -135.52 165.26 25.92 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.059 -0.519 . . . . 63.140000000000001 111.116 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 3.8 ttm -87.28 143.19 27.38 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.923 1.289 . . . . 74.010000000000005 111.031 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 34.3 mt -148.09 139.54 23.6 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.739 0.304 . . . . 52.390000000000001 111.209 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -79.5 162.52 25.36 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 120.271 -0.572 . . . . 58.18 110.107 165.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 43.7 mttt -50.93 -39.42 54.71 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.968 1.47 . . . . 47.799999999999997 114.968 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.6 m -66.63 -43.46 84.63 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 122.645 0.378 . . . . 61.200000000000003 111.885 -177.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -52.02 -50.29 61.7 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 123.488 0.493 . . . . 53.619999999999997 110.113 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.2 t -59.14 -51.44 72.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 116.432 -0.349 . . . . 48.609999999999999 110.658 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.61 -32.09 72.2 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.43 0.53 . . . . 55.939999999999998 112.43 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -74.2 -39.28 63.25 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 116.535 -0.302 . . . . 71.890000000000001 110.44 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.84 -40.29 91.59 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.709 1.204 . . . . 60.369999999999997 114.226 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.406 HG21 ' HB3' ' A' ' 26' ' ' GLN . 4.3 pt -106.15 149.06 9.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 C-N-CA 120.176 -0.609 . . . . 56.909999999999997 109.969 179.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLN . . . . . 1.043 ' HA ' ' OE1' ' A' ' 51' ' ' GLN 0.369 0.0 OUTLIER -90.22 64.33 6.03 Favored 'General case' 0 CA--C 1.503 -0.849 0 N-CA-C 117.392 2.367 . . . . 74.989999999999995 117.392 -176.446 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.8 mt -133.89 158.26 43.9 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 113.071 -1.877 . . . . 57.969999999999999 107.421 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 78.0 p -66.63 153.28 43.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.589 . . . . 60.329999999999998 112.081 -175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -50.38 -53.14 48.22 Favored Pre-proline 0 CA--C 1.533 0.303 0 N-CA-C 112.775 0.657 . . . . 67.980000000000004 112.775 176.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_exo -50.29 -48.25 20.8 Favored 'Trans proline' 0 C--N 1.355 0.882 0 O-C-N 122.568 0.773 . . . . 58.25 113.885 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . 0.485 HG22 ' SG ' ' A' ' 23' ' ' CYS . 96.4 m -58.94 -55.79 30.54 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-O 121.497 0.665 . . . . 50.399999999999999 111.558 177.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.3 t -61.66 -45.02 99.54 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 N-CA-C 112.978 0.733 . . . . 42.719999999999999 112.978 -177.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -62.63 -46.86 86.29 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 117.503 0.138 . . . . 49.960000000000001 111.303 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -60.66 -37.77 82.64 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.916 0.389 . . . . 39.390000000000001 111.561 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 37.2 m -65.63 -46.35 79.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.453 -0.794 . . . . 37.619999999999997 111.077 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.2 t -55.83 -51.76 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.268 0.627 . . . . 38.390000000000001 110.728 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -53.07 -51.68 61.04 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.072 0.767 . . . . 41.240000000000002 113.072 175.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.3 m -64.53 -38.66 91.77 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 119.894 -0.723 . . . . 41.189999999999998 112.353 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.406 ' HZ ' ' HB1' ' A' ' 24' ' ' ALA . 7.0 m-30 -63.52 -32.07 73.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.474 1.287 . . . . 43.710000000000001 114.474 176.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -69.89 -36.9 75.82 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 120.69 -0.404 . . . . 48.700000000000003 111.704 168.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.8 m -61.53 -47.68 84.49 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.681 0.277 . . . . 48.460000000000001 110.708 175.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.58 -20.32 64.59 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.267 1.027 . . . . 51.869999999999997 112.37 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.05 18.51 57.66 Favored Glycine 0 N--CA 1.465 0.578 0 CA-C-O 120.21 -0.217 . . . . 51.259999999999998 112.702 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 17.0 m-30 -84.71 -32.44 23.53 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 116.596 0.198 . . . . 53.740000000000002 111.519 179.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 1.4 pt -122.34 150.77 25.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 O-C-N 123.426 0.454 . . . . 45.899999999999999 110.435 173.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 81' ' ' TYR . 77.9 m-20 -98.98 152.27 19.99 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.302 0.573 . . . . 55.109999999999999 111.301 177.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -117.0 136.13 53.17 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 107.218 -1.401 . . . . 54.060000000000002 107.218 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 119' ' ' HOH . 0.9 OUTLIER -140.45 134.41 30.69 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.393 -0.923 . . . . 59.210000000000001 109.687 174.924 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -74.35 138.84 43.72 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.793 -0.817 . . . . 61.340000000000003 108.793 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -159.29 119.39 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 N-CA-C 105.519 -2.03 . . . . 65.349999999999994 105.519 -168.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.09 -135.18 43.15 Favored Glycine 0 N--CA 1.473 1.131 0 N-CA-C 106.76 -2.536 . . . . 72.480000000000004 106.76 -163.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.28 19.71 19.55 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 117.662 0.731 . . . . 90.659999999999997 111.112 167.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.36 -167.08 1.3 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.18 -0.918 . . . . 63.590000000000003 112.216 170.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -126.53 154.35 43.95 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.214 -0.903 . . . . 55.240000000000002 110.751 -171.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.505 HG13 HG23 ' A' ' 73' ' ' THR . 4.3 pt -132.88 152.68 36.54 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 CA-C-O 121.95 0.881 . . . . 62.710000000000001 113.306 170.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.434 ' HA ' ' O ' ' A' ' 71' ' ' ASP . 78.2 m-85 -117.09 135.2 53.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 113.537 -1.665 . . . . 51.479999999999997 111.747 -172.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 38.8 p -134.55 155.16 50.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.355 -1.72 . . . . 57.109999999999999 106.355 173.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 mt -66.68 138.33 57.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.6 -0.889 . . . . 57.869999999999997 108.6 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 79.6 p -74.65 178.91 5.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.75 -0.833 . . . . 61.350000000000001 108.75 168.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -62.54 -34.58 77.2 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.956 0.407 . . . . 82.700000000000003 110.097 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.9 tp -63.14 -44.41 95.64 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.316 -0.856 . . . . 64.689999999999998 109.773 174.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -57.25 -52.24 52.7 Favored Glycine 0 C--N 1.338 0.671 0 CA-C-N 115.568 -0.742 . . . . 55.859999999999999 111.359 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 66.0 t -56.79 -41.47 75.48 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.284 0.475 . . . . 68.829999999999998 112.284 177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.3 -40.76 96.59 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.82 0.674 . . . . 89.569999999999993 112.82 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.64 -47.45 92.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 123.187 0.595 . . . . 62.43 111.779 173.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.43 -36.57 41.63 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 N-CA-C 112.679 0.622 . . . . 66.819999999999993 112.679 175.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 96' ' ' GLN . 25.0 mm-40 -61.69 -36.46 80.94 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 114.511 1.3 . . . . 90.689999999999998 114.511 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' CYS . . . . . . . . . . . . . 36.5 m -62.71 -40.01 95.83 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.905 -0.405 . . . . 78.939999999999998 109.905 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -67.93 -46.81 70.48 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 113.811 1.041 . . . . 76.370000000000005 113.811 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -52.89 -39.04 62.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.683 -0.689 . . . . 89.799999999999997 111.794 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 42.6 mt-30 -69.14 -39.01 79.1 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.908 0.707 . . . . 109.92 112.908 179.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 39.2 mmtt -55.51 -53.73 52.7 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 123.458 0.474 . . . . 95.569999999999993 109.735 171.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 113.359 0.874 . . . . 100.09999999999999 113.359 -177.193 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . 0.535 ' O ' HG22 ' A' ' 73' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . 0.447 ' O ' ' NE2' ' A' ' 26' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_