data_2qti_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 2qti _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 ' 8' ' ' SER . . . . . . . . . . . . . 23.7 t . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.999 -0.741 . . . . 61.950000000000003 108.999 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . . . -62.13 -38.63 89.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 58.18 109.938 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.5 m -70.27 -28.44 65.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.025 -0.732 . . . . 53.869999999999997 109.025 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -71.43 -44.92 63.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.699 . . . . 51.259999999999998 109.615 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.83 -51.15 64.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.663 -0.866 . . . . 48.299999999999997 108.663 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -56.34 -39.55 73.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.021 -0.99 . . . . 62.710000000000001 113.002 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.6 m -65.34 -43.19 91.67 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.507 -0.183 . . . . 38.100000000000001 110.507 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mt -60.31 -49.04 79.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.545 -0.909 . . . . 45.57 108.545 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.78 -50.23 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 114.628 -1.169 . . . . 34.920000000000002 111.198 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.35 84.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.284 0.564 . . . . 33.740000000000002 110.402 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.08 -42.7 91.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.54 -0.755 . . . . 45.0 111.015 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.7 mt -68.77 -40.84 81.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.428 -0.509 . . . . 37.259999999999998 109.894 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.2 -37.1 86.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.828 -0.749 . . . . 39.840000000000003 112.355 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.5 t -63.89 -37.72 80.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.145 -0.687 . . . . 37.109999999999999 109.145 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.85 -46.74 83.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.812 -0.81 . . . . 39.210000000000001 108.812 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.88 -42.98 89.62 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.104 -0.498 . . . . 40.270000000000003 110.698 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -64.64 -39.78 94.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.295 -0.411 . . . . 69.769999999999996 111.744 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -60.17 -35.15 74.71 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 112.214 0.45 . . . . 56.850000000000001 112.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -84.83 -9.38 58.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.763 -0.199 . . . . 53.789999999999999 111.069 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt 55.18 30.49 14.61 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 105.453 -2.054 . . . . 85.680000000000007 105.453 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.17 133.45 92.79 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.024 -0.989 . . . . 51.490000000000002 111.995 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -60.73 165.16 12.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.935 2.423 . . . . 45.020000000000003 109.819 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.6 m -57.75 -52.56 64.97 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.791 0.329 . . . . 44.600000000000001 111.188 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -55.92 -41.0 73.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.864 0.32 . . . . 54.640000000000001 111.864 -179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 45.0 tp -67.28 -40.24 86.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.995 0.426 . . . . 42.920000000000002 110.352 179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -62.04 -47.73 83.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 37.68 110.067 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.32 -44.36 95.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.917 -0.583 . . . . 38.240000000000002 111.278 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 34.5 ttm -60.77 -43.02 98.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.806 -0.634 . . . . 74.870000000000005 110.432 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.19 -46.86 72.65 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.536 -0.542 . . . . 32.07 109.536 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.1 mt -61.38 -40.75 95.47 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.015 -0.539 . . . . 28.809999999999999 110.801 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.19 97.48 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 110.408 -1.077 . . . . 32.909999999999997 110.408 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -63.55 -33.23 75.14 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.43 -0.508 . . . . 45.950000000000003 110.617 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 67.0 m -65.5 -41.82 92.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 119.263 -0.975 . . . . 33.350000000000001 109.644 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t -63.58 -47.84 89.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.203 -1.036 . . . . 31.620000000000001 108.203 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.8 m -55.91 -46.68 78.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.277 -0.419 . . . . 40.82 110.164 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -55.71 -54.59 42.47 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.533 -0.543 . . . . 57.920000000000002 109.533 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -54.65 -50.37 68.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 113.117 0.784 . . . . 49.579999999999998 113.117 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 24.2 mt -57.95 -43.28 86.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.861 -0.336 . . . . 45.600000000000001 111.768 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -67.54 -37.4 82.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.19 -0.459 . . . . 77.719999999999999 110.969 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -89.98 -18.51 25.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 117.079 2.251 . . . . 100.0 117.079 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -131.68 1.26 4.02 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 116.926 2.195 . . . . 72.299999999999997 116.926 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.7 t -121.82 126.29 26.43 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.052 0.453 . . . . 47.399999999999999 110.368 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -49.93 133.21 33.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.08 1.854 . . . . 56.439999999999998 111.358 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.3 t -39.98 -39.19 0.81 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.189 1.181 . . . . 55.969999999999999 114.189 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -69.93 -19.97 63.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 116.013 1.857 . . . . 70.230000000000004 116.013 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.6 m -110.25 -14.4 14.17 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.352 0.596 . . . . 42.280000000000001 112.297 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -44.62 -54.53 6.04 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.019 1.488 . . . . 51.329999999999998 115.019 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -60.08 -44.14 94.98 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.557 -0.457 . . . . 47.700000000000003 109.834 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.77 84.26 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.091 -0.504 . . . . 35.25 110.802 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.9 t -62.69 -39.39 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 119.374 -0.93 . . . . 36.399999999999999 108.868 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.07 92.93 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.716 -0.476 . . . . 32.18 109.716 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.87 -38.57 89.17 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.97 0.73 . . . . 70.799999999999997 112.97 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -68.66 -34.24 75.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.08 -0.711 . . . . 49.899999999999999 109.08 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.26 -44.42 95.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.984 -1.858 . . . . 32.100000000000001 105.984 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.93 -44.17 96.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.577 -0.738 . . . . 34.200000000000003 112.776 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -61.16 -46.68 89.53 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.105 -0.702 . . . . 75.510000000000005 109.105 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.14 90.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.948 -0.76 . . . . 34.689999999999998 108.948 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.11 -50.43 73.74 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.564 -0.854 . . . . 39.390000000000001 109.843 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.19 -48.29 79.11 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.363 -0.38 . . . . 37.979999999999997 111.068 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.9 -43.79 98.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.398 -0.593 . . . . 65.200000000000003 109.398 179.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -54.39 -57.63 10.55 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.229 -0.656 . . . . 51.240000000000002 109.229 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 75.2 t -53.5 -48.35 58.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.268 -0.424 . . . . 48.810000000000002 111.985 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.99 -59.81 4.23 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.253 -0.431 . . . . 75.480000000000004 110.465 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 m -54.02 -40.02 66.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 69.079999999999998 111.148 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -59.46 -18.76 42.4 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.534 -0.543 . . . . 92.209999999999994 109.534 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.9 mp -87.27 49.62 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.466 -1.309 . . . . 77.819999999999993 107.466 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.687 -0.673 . . . . 80.950000000000003 111.226 179.927 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 110' ' ' 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 ' 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 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.7 t . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.999 -0.741 . . . . 61.95 108.999 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . . . -62.13 -38.63 89.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 58.18 109.938 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.5 m -70.27 -28.44 65.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.025 -0.732 . . . . 53.87 109.025 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -71.43 -44.92 63.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.699 . . . . 51.26 109.615 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.83 -51.15 64.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.663 -0.866 . . . . 48.3 108.663 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -56.34 -39.55 73.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.021 -0.99 . . . . 62.71 113.002 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.6 m -65.34 -43.19 91.67 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.507 -0.183 . . . . 38.1 110.507 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mt -60.31 -49.04 79.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.545 -0.909 . . . . 45.57 108.545 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.78 -50.23 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 114.628 -1.169 . . . . 34.92 111.198 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.35 84.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.284 0.564 . . . . 33.74 110.402 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.08 -42.7 91.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.54 -0.755 . . . . 45.0 111.015 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.7 mt -68.77 -40.84 81.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.428 -0.509 . . . . 37.26 109.894 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.2 -37.1 86.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.828 -0.749 . . . . 39.84 112.355 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.5 t -63.89 -37.72 80.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.145 -0.687 . . . . 37.11 109.145 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.85 -46.74 83.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.812 -0.81 . . . . 39.21 108.812 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.88 -42.98 89.62 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.104 -0.498 . . . . 40.27 110.698 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -64.64 -39.78 94.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.295 -0.411 . . . . 69.77 111.744 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -60.17 -35.15 74.71 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 112.214 0.45 . . . . 56.85 112.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -84.83 -9.38 58.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.763 -0.199 . . . . 53.79 111.069 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt 55.18 30.49 14.61 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 105.453 -2.054 . . . . 85.68 105.453 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.645 ' HB1' HD23 ' A' ' 32' ' ' LEU . . . -61.17 133.45 92.79 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.024 -0.989 . . . . 51.49 111.995 -179.031 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . 0.413 ' HB2' ' OD1' ' A' ' 31' ' ' ASP . 59.6 Cg_exo -60.73 165.16 12.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.935 2.423 . . . . 45.02 109.819 179.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.6 m -57.75 -52.56 64.97 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.791 0.329 . . . . 44.6 111.188 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 29' ' ' PRO . 22.4 p-10 -55.92 -41.0 73.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.864 0.32 . . . . 54.64 111.864 -179.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.645 HD23 ' HB1' ' A' ' 28' ' ' ALA . 45.0 tp -67.28 -40.24 86.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.995 0.426 . . . . 42.92 110.352 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -62.04 -47.73 83.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 37.68 110.067 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.32 -44.36 95.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.917 -0.583 . . . . 38.24 111.278 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 34.5 ttm -60.77 -43.02 98.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.806 -0.634 . . . . 74.87 110.432 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.19 -46.86 72.65 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.536 -0.542 . . . . 32.07 109.536 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.1 mt -61.38 -40.75 95.47 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.015 -0.539 . . . . 28.81 110.801 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.19 97.48 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 110.408 -1.077 . . . . 32.91 110.408 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -63.55 -33.23 75.14 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.43 -0.508 . . . . 45.95 110.617 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 67.0 m -65.5 -41.82 92.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 119.263 -0.975 . . . . 33.35 109.644 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t -63.58 -47.84 89.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.203 -1.036 . . . . 31.62 108.203 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' GLU . 22.8 m -55.91 -46.68 78.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.277 -0.419 . . . . 40.82 110.164 179.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -55.71 -54.59 42.47 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.533 -0.543 . . . . 57.92 109.533 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -54.65 -50.37 68.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 113.117 0.784 . . . . 49.58 113.117 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HB3' ' HG3' ' A' ' 54' ' ' ARG . 24.2 mt -57.95 -43.28 86.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.861 -0.336 . . . . 45.6 111.768 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 42' ' ' THR . 30.7 mt-10 -67.54 -37.4 82.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.19 -0.459 . . . . 77.72 110.969 -179.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -89.98 -18.51 25.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 117.079 2.251 . . . . 100.0 117.079 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -131.68 1.26 4.02 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 116.926 2.195 . . . . 72.3 116.926 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.7 t -121.82 126.29 26.43 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.052 0.453 . . . . 47.4 110.368 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -49.93 133.21 33.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.08 1.854 . . . . 56.44 111.358 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.3 t -39.98 -39.19 0.81 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.189 1.181 . . . . 55.97 114.189 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -69.93 -19.97 63.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 116.013 1.857 . . . . 70.23 116.013 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.6 m -110.25 -14.4 14.17 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.352 0.596 . . . . 42.28 112.297 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 45' ' ' LEU . 12.0 ttm180 -44.62 -54.53 6.04 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.019 1.488 . . . . 51.33 115.019 -178.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -60.08 -44.14 94.98 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.557 -0.457 . . . . 47.7 109.834 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.77 84.26 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.091 -0.504 . . . . 35.25 110.802 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.9 t -62.69 -39.39 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 119.374 -0.93 . . . . 36.4 108.868 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.07 92.93 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.716 -0.476 . . . . 32.18 109.716 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.87 -38.57 89.17 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.97 0.73 . . . . 70.8 112.97 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -68.66 -34.24 75.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.08 -0.711 . . . . 49.9 109.08 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.26 -44.42 95.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.984 -1.858 . . . . 32.1 105.984 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.93 -44.17 96.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.577 -0.738 . . . . 34.2 112.776 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -61.16 -46.68 89.53 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.105 -0.702 . . . . 75.51 109.105 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.14 90.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.948 -0.76 . . . . 34.69 108.948 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.11 -50.43 73.74 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.564 -0.854 . . . . 39.39 109.843 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.19 -48.29 79.11 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.363 -0.38 . . . . 37.98 111.068 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.9 -43.79 98.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.398 -0.593 . . . . 65.2 109.398 179.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -54.39 -57.63 10.55 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.229 -0.656 . . . . 51.24 109.229 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . 0.511 ' O ' HD13 ' A' ' 73' ' ' LEU . 75.2 t -53.5 -48.35 58.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.268 -0.424 . . . . 48.81 111.985 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 88.2 tttt -54.99 -59.81 4.23 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.253 -0.431 . . . . 75.48 110.465 -179.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 m -54.02 -40.02 66.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 69.08 111.148 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -59.46 -18.76 42.4 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.534 -0.543 . . . . 92.21 109.534 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 70' ' ' LYS . 7.9 mp -87.27 49.62 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.466 -1.309 . . . . 77.82 107.466 178.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.687 -0.673 . . . . 80.95 111.226 179.927 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 110' ' ' 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 ' 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 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.7 t . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.999 -0.741 . . . . 61.95 108.999 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . . . -62.13 -38.63 89.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 58.18 109.938 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 18.5 m -70.27 -28.44 65.21 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.025 -0.732 . . . . 53.87 109.025 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . . . -71.43 -44.92 63.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.699 . . . . 51.26 109.615 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.83 -51.15 64.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.663 -0.866 . . . . 48.3 108.663 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -56.34 -39.55 73.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.021 -0.99 . . . . 62.71 113.002 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.6 m -65.34 -43.19 91.67 Favored 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 110.507 -0.183 . . . . 38.1 110.507 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mt -60.31 -49.04 79.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 108.545 -0.909 . . . . 45.57 108.545 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 74.6 mt -56.78 -50.23 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-N 114.628 -1.169 . . . . 34.92 111.198 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.35 84.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.284 0.564 . . . . 33.74 110.402 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -59.08 -42.7 91.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.54 -0.755 . . . . 45.0 111.015 -178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 84.7 mt -68.77 -40.84 81.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.428 -0.509 . . . . 37.26 109.894 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 66.7 mt -64.2 -37.1 86.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.828 -0.749 . . . . 39.84 112.355 -178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.5 t -63.89 -37.72 80.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.145 -0.687 . . . . 37.11 109.145 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.85 -46.74 83.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 108.812 -0.81 . . . . 39.21 108.812 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.88 -42.98 89.62 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.104 -0.498 . . . . 40.27 110.698 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -64.64 -39.78 94.3 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.295 -0.411 . . . . 69.77 111.744 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -60.17 -35.15 74.71 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 112.214 0.45 . . . . 56.85 112.214 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 m80 -84.83 -9.38 58.21 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.763 -0.199 . . . . 53.79 111.069 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt 55.18 30.49 14.61 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 105.453 -2.054 . . . . 85.68 105.453 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.645 ' HB1' HD23 ' A' ' 32' ' ' LEU . . . -61.17 133.45 92.79 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.024 -0.989 . . . . 51.49 111.995 -179.031 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.413 ' HB2' ' OD1' ' A' ' 31' ' ' ASP . 59.6 Cg_exo -60.73 165.16 12.2 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.935 2.423 . . . . 45.02 109.819 179.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.6 m -57.75 -52.56 64.97 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.791 0.329 . . . . 44.6 111.188 179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.413 ' OD1' ' HB2' ' A' ' 29' ' ' PRO . 22.4 p-10 -55.92 -41.0 73.9 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.864 0.32 . . . . 54.64 111.864 -179.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.645 HD23 ' HB1' ' A' ' 28' ' ' ALA . 45.0 tp -67.28 -40.24 86.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.995 0.426 . . . . 42.92 110.352 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.9 m -62.04 -47.73 83.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 37.68 110.067 -179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.32 -44.36 95.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.917 -0.583 . . . . 38.24 111.278 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' MSE . . . . . . . . . . . . . 34.5 ttm -60.77 -43.02 98.59 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.806 -0.634 . . . . 74.87 110.432 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -67.19 -46.86 72.65 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 109.536 -0.542 . . . . 32.07 109.536 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 86.1 mt -61.38 -40.75 95.47 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 116.015 -0.539 . . . . 28.81 110.801 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -64.17 -43.19 97.48 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 110.408 -1.077 . . . . 32.91 110.408 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -63.55 -33.23 75.14 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 120.43 -0.508 . . . . 45.95 110.617 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 67.0 m -65.5 -41.82 92.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 119.263 -0.975 . . . . 33.35 109.644 178.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t -63.58 -47.84 89.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 108.203 -1.036 . . . . 31.62 108.203 178.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' GLU . 22.8 m -55.91 -46.68 78.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.277 -0.419 . . . . 40.82 110.164 179.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -55.71 -54.59 42.47 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.533 -0.543 . . . . 57.92 109.533 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -54.65 -50.37 68.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 113.117 0.784 . . . . 49.58 113.117 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HB3' ' HG3' ' A' ' 54' ' ' ARG . 24.2 mt -57.95 -43.28 86.27 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.861 -0.336 . . . . 45.6 111.768 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 42' ' ' THR . 30.7 mt-10 -67.54 -37.4 82.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.19 -0.459 . . . . 77.72 110.969 -179.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -89.98 -18.51 25.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 117.079 2.251 . . . . 100.0 117.079 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -131.68 1.26 4.02 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 116.926 2.195 . . . . 72.3 116.926 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.7 t -121.82 126.29 26.43 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.052 0.453 . . . . 47.4 110.368 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -49.93 133.21 33.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.08 1.854 . . . . 56.44 111.358 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.3 t -39.98 -39.19 0.81 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 114.189 1.181 . . . . 55.97 114.189 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -69.93 -19.97 63.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 116.013 1.857 . . . . 70.23 116.013 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.6 m -110.25 -14.4 14.17 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.352 0.596 . . . . 42.28 112.297 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.452 ' HG3' ' HB3' ' A' ' 45' ' ' LEU . 12.0 ttm180 -44.62 -54.53 6.04 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.019 1.488 . . . . 51.33 115.019 -178.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 40.4 tp60 -60.08 -44.14 94.98 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.557 -0.457 . . . . 47.7 109.834 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.41 -47.77 84.26 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.091 -0.504 . . . . 35.25 110.802 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 84.9 t -62.69 -39.39 84.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 119.374 -0.93 . . . . 36.4 108.868 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.42 -44.07 92.93 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.716 -0.476 . . . . 32.18 109.716 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -65.87 -38.57 89.17 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.97 0.73 . . . . 70.8 112.97 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -68.66 -34.24 75.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.08 -0.711 . . . . 49.9 109.08 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.26 -44.42 95.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.984 -1.858 . . . . 32.1 105.984 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.93 -44.17 96.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.577 -0.738 . . . . 34.2 112.776 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.3 mmtm -61.16 -46.68 89.53 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.105 -0.702 . . . . 75.51 109.105 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.72 -45.14 90.24 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.948 -0.76 . . . . 34.69 108.948 179.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 55.3 tp -60.11 -50.43 73.74 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.564 -0.854 . . . . 39.39 109.843 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -57.19 -48.29 79.11 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.363 -0.38 . . . . 37.98 111.068 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.9 -43.79 98.13 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.398 -0.593 . . . . 65.2 109.398 179.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -54.39 -57.63 10.55 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.229 -0.656 . . . . 51.24 109.229 179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.511 ' O ' HD13 ' A' ' 73' ' ' LEU . 75.2 t -53.5 -48.35 58.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.268 -0.424 . . . . 48.81 111.985 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 88.2 tttt -54.99 -59.81 4.23 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.253 -0.431 . . . . 75.48 110.465 -179.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 71.0 m -54.02 -40.02 66.65 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.136 -0.484 . . . . 69.08 111.148 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -59.46 -18.76 42.4 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.534 -0.543 . . . . 92.21 109.534 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 70' ' ' LYS . 7.9 mp -87.27 49.62 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.466 -1.309 . . . . 77.82 107.466 178.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.24 0 CA-C-O 118.687 -0.673 . . . . 80.95 111.226 179.927 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 110' ' ' 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 ' 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_