data_1b6e_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 1b6e _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 ' 59' ' ' CYS . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.259 0.552 . . . . 63.3 110.024 . -49.922 -126.204 -87.907 103.338 2.036 106.953 72.817 -160.927 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 p -64.06 151.91 41.75 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.975 -0.557 . . . . 61.49 112.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 25.1 m -127.44 174.86 8.67 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.79 -0.641 . . . . 57.22 112.468 179.766 -48.949 -87.895 -77.975 103.287 2.025 105.136 -80.187 -52.094 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . 0.491 ' O ' ' O ' ' A' ' 63' ' ' GLU . 2.6 mm100 -71.84 176.76 4.68 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.495 0.554 . . . . 77.01 112.495 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 62' ' ' GLN . 1.0 OUTLIER -27.45 -115.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 117.916 2.561 . . . . 74.04 117.916 -179.085 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.75 46.77 0.07 Allowed 'General case' 0 C--O 1.232 0.164 0 N-CA-C 115.131 1.53 . . . . 61.61 115.131 -178.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 48.5 m95 -111.75 147.89 34.69 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 107.769 -1.197 . . . . 54.14 107.769 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -110.01 125.11 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.444 0.905 . . . . 36.28 113.444 -178.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -91.45 135.36 12.75 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 117.655 1.822 . . . . 29.36 117.655 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -158.04 144.5 17.56 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.631 -0.877 . . . . 40.38 108.631 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 41.99 47.47 3.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.936 -0.574 . . . . 62.56 109.825 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.2 t 46.93 51.75 12.39 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.633 0.73 . . . . 55.74 110.515 -179.491 -160.927 72.817 -87.907 106.953 2.036 103.338 -126.204 -49.922 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -146.05 147.96 32.17 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 107.564 -1.272 . . . . 48.26 107.564 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 38.2 m -109.6 129.59 55.57 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.371 -0.931 . . . . 43.32 109.815 178.565 -52.094 -80.187 -77.975 105.136 2.025 103.287 -87.895 -48.949 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -118.96 151.69 37.73 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 30.52 109.21 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -127.46 115.2 18.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 106.625 -1.621 . . . . 27.37 106.625 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.14 88.57 1.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-O 121.489 0.661 . . . . 30.58 110.067 -179.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.9 p -50.55 153.59 1.58 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 117.938 2.57 . . . . 32.65 117.938 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.24 -41.71 7.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 107.455 -1.313 . . . . 41.61 107.455 177.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.5 153.96 37.39 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 112.631 0.604 . . . . 65.19 112.631 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.66 126.83 52.78 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 106.605 -1.628 . . . . 53.75 106.605 177.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' NZ ' ' O ' ' A' ' 2' ' ' HOH . 7.7 mmmt -133.58 -171.23 2.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 114.345 1.239 . . . . 40.25 114.345 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . 0.436 ' OG1' ' CG ' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -89.22 154.52 20.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.137 -1.801 . . . . 44.47 106.137 178.617 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' TRP . . . . . 0.577 ' CG ' ' SG ' ' A' ' 152' ' ' CYS . 10.7 t90 -64.62 -29.87 70.88 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.279 0.474 . . . . 35.69 112.279 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -80.43 -23.6 40.21 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 118.283 -1.367 . . . . 38.15 109.744 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . 0.436 ' CG ' ' OG1' ' A' ' 81' ' ' THR . 3.1 mt-10 -72.97 -63.85 1.09 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.552 0.692 . . . . 43.95 109.549 178.728 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.2 -47.5 24.19 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.026 -1.842 . . . . 31.95 106.026 179.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.3 ttp180 -45.06 -43.32 9.37 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.659 -1.155 . . . . 34.37 109.464 178.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . 0.425 ' N ' ' O ' ' A' ' 84' ' ' GLU . 7.9 m80 -81.69 -34.96 30.37 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.591 -1.186 . . . . 31.95 112.528 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.81 -44.58 95.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 118.808 -1.157 . . . . 36.23 109.767 -179.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 92.6 m -62.32 -47.36 84.6 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 108.602 -0.888 . . . . 30.23 108.602 179.919 -68.514 -54.332 -71.956 102.951 2.027 101.837 -66.587 -38.458 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.17 74.68 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 107.835 -1.172 . . . . 30.31 107.835 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -32.69 71.94 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.623 -1.172 . . . . 37.91 108.019 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . 0.429 ' NE2' ' O ' ' A' ' 21' ' ' HOH . 7.0 mt-30 -101.67 38.36 1.63 Allowed 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 115.5 1.667 . . . . 40.86 115.5 -178.505 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.82 29.04 2.11 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.715 1.006 . . . . 57.04 113.715 179.036 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 63.0 p -129.14 -154.41 0.63 Allowed 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 106.194 -1.78 . . . . 29.46 106.194 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.8 p -173.55 143.52 1.04 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.266 1.951 . . . . 23.14 116.266 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . 0.433 ' O ' ' N ' ' A' ' 118' ' ' GLY . 6.1 tp -43.17 92.32 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.778 2.14 . . . . 29.33 116.778 -178.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.3 tp 1.28 117.57 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 1 N-CA-C 124.076 4.843 . . . . 22.63 124.076 179.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . 0.475 ' NE2' ' O ' ' A' ' 14' ' ' HOH . 4.5 tt0 -113.33 109.62 19.02 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 103.161 -2.903 . . . . 42.98 103.161 176.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 13.7 mt -69.53 112.86 6.32 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.833 1.049 . . . . 29.91 113.833 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 51.1 mm-40 -77.98 -4.8 48.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.37 -0.604 . . . . 45.1 109.37 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 13.5 p30 160.38 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.057 1.743 . . . . 39.45 112.116 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -44.75 -26.96 0.44 Allowed 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 114.664 1.357 . . . . 39.84 114.664 -178.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.93 44.55 1.02 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.008 1.114 . . . . 52.74 114.008 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -91.59 -23.5 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.353 -0.539 . . . . 40.26 111.058 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.0 mt -117.03 44.2 2.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.04 1.126 . . . . 39.54 114.04 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -38.16 -55.72 1.26 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.351 0.661 . . . . 45.4 110.98 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . 0.464 ' C ' ' N ' ' A' ' 109' ' ' SER . 36.3 p90 -51.36 -59.87 3.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 113.819 1.044 . . . . 44.25 113.819 -177.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' MET . . . . . 0.619 ' O ' ' N ' ' A' ' 110' ' ' SER . 0.0 OUTLIER -58.62 3.35 0.03 OUTLIER 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.323 0.583 . . . . 53.02 111.278 -179.683 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . 0.464 ' N ' ' C ' ' A' ' 107' ' ' PHE . 30.8 t -10.23 -36.0 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 120.818 3.636 . . . . 57.81 120.818 -179.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 108' ' ' MET . 0.2 OUTLIER -111.66 -38.02 5.01 Favored 'General case' 0 C--N 1.327 -0.381 1 N-CA-C 122.138 4.125 . . . . 62.44 122.138 -176.541 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . 0.517 ' O ' ' ND2' ' A' ' 156' ' ' ASN . 0.1 OUTLIER -17.78 109.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 115.773 1.768 . . . . 65.36 115.773 -179.534 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.1 38.0 0.64 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.325 0.583 . . . . 76.5 110.959 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -131.53 150.66 52.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.464 -0.939 . . . . 59.04 108.464 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -92.87 167.69 11.67 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.739 -0.784 . . . . 49.13 112.839 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 155' ' ' TYR . 74.4 m-85 -137.98 161.84 35.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.576 -0.898 . . . . 38.94 108.576 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TRP . . . . . 0.425 ' N ' ' O ' ' A' ' 171' ' ' ARG . 0.0 OUTLIER -83.55 146.09 28.52 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.88 -2.267 . . . . 43.1 104.88 179.708 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.88 159.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 119.664 -0.814 . . . . 30.47 109.07 176.166 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 96' ' ' LEU . . . -66.42 18.53 0.21 Allowed Glycine 0 C--N 1.331 0.303 0 N-CA-C 122.451 3.74 . . . . 30.45 122.451 -176.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 12.9 tp -98.07 132.1 43.9 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.608 -0.516 . . . . 30.98 109.608 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.01 150.66 29.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.923 -0.769 . . . . 33.13 108.923 -179.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TYR . . . . . 0.422 ' CD2' ' N ' ' A' ' 122' ' ' SER . 38.7 t80 -70.28 165.96 21.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.207 -0.997 . . . . 32.26 111.71 -179.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . 0.422 ' N ' ' CD2' ' A' ' 121' ' ' TYR . 1.7 t -155.77 93.9 1.51 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.463 0.649 . . . . 31.44 111.29 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -52.71 -26.68 14.71 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.771 -1.104 . . . . 50.23 113.156 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 77.2 tt0 -65.07 -30.29 71.23 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 117.552 -1.659 . . . . 38.54 113.849 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HIS . . . . . 0.472 ' O ' ' C ' ' A' ' 126' ' ' THR . 6.0 m80 -118.77 19.36 13.16 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.948 -0.76 . . . . 34.29 108.948 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 125' ' ' HIS . 0.8 OUTLIER 28.09 72.88 0.04 OUTLIER 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 107.78 -1.192 . . . . 28.93 107.78 -176.766 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -174.84 159.41 2.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.651 0.595 . . . . 27.17 110.476 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' TRP . . . . . 0.443 ' CZ2' ' CB ' ' A' ' 147' ' ' PHE . 82.4 m95 -88.14 137.47 32.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 103.007 -2.961 . . . . 31.41 103.007 177.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 21.3 mt -129.31 155.78 45.06 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 114.861 1.43 . . . . 23.44 114.861 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' TRP . . . . . . . . . . . . . 98.6 m95 -86.63 -176.29 5.76 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 104.159 -2.534 . . . . 26.78 104.159 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -65.51 -33.77 76.71 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 118.218 -1.393 . . . . 31.53 113.138 -179.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.82 12.96 13.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 114.184 1.179 . . . . 22.71 114.184 -178.664 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 84.61 13.09 73.72 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 119.201 2.44 . . . . 20.24 119.201 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.5 140.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 105.055 -2.202 . . . . 25.04 105.055 178.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.15 159.26 33.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 120.558 -0.457 . . . . 32.23 110.049 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 11.2 tp -81.47 129.95 34.85 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.807 -0.812 . . . . 34.41 108.807 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 t -65.66 132.41 48.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 118.479 -1.289 . . . . 38.55 109.479 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -63.66 -23.22 67.28 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 116.817 2.154 . . . . 41.63 116.817 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -99.07 -1.41 39.66 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.635 -0.426 . . . . 44.18 111.647 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -88.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 101.196 -3.631 . . . . 45.34 101.196 178.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -75.57 137.63 70.75 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.477 -0.934 . . . . 54.99 108.477 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' O ' ' N ' ' A' ' 144' ' ' PHE . 36.4 Cg_endo -82.3 -58.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 120.74 0.96 . . . . 55.24 110.682 -179.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' SER . . . . . 0.498 ' O ' ' C ' ' A' ' 144' ' ' PHE . 0.0 OUTLIER -35.54 -33.89 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.543 -0.753 . . . . 55.4 109.96 178.677 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PHE . . . . . 0.498 ' C ' ' O ' ' A' ' 143' ' ' SER . 1.4 t80 13.03 -96.08 0.0 OUTLIER 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.325 0.861 . . . . 59.89 113.325 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -34.35 -20.8 0.0 OUTLIER 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.503 2.038 . . . . 61.91 116.503 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . 0.463 ' N ' ' O ' ' A' ' 144' ' ' PHE . 2.0 t -76.19 -50.11 15.4 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.453 -0.499 . . . . 65.02 110.488 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PHE . . . . . 0.443 ' CB ' ' CZ2' ' A' ' 128' ' ' TRP . 16.4 m-30 -25.4 108.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 116.07 1.878 . . . . 58.56 116.07 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASN . . . . . 0.636 ' O ' ' N ' ' A' ' 150' ' ' LYS . 2.2 t-20 -76.36 102.22 5.83 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 119.745 -0.782 . . . . 56.9 110.771 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 40.7 p -31.13 -16.77 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 117.635 2.457 . . . . 45.37 117.635 -177.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 148' ' ' ASN . 4.8 mtpp -94.45 17.1 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 119.175 -1.01 . . . . 46.68 110.404 178.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -123.95 168.92 12.16 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.357 1.614 . . . . 47.79 115.357 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' CYS . . . . . 0.577 ' SG ' ' CG ' ' A' ' 82' ' ' TRP . 6.8 m -99.41 167.0 10.91 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.679 -1.23 . . . . 46.25 107.679 177.618 -85.056 60.766 104.297 102.673 2.026 102.323 -70.982 -76.462 2 2 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 25.5 mm -105.52 125.42 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 C-N-CA 119.13 -1.028 . . . . 48.82 112.332 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -107.08 147.92 29.4 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 102.619 -3.104 . . . . 44.28 102.619 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' TYR . . . . . 0.441 ' O ' ' N ' ' A' ' 115' ' ' TYR . 79.9 t80 -134.4 156.05 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.736 0.779 . . . . 44.88 112.61 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ASN . . . . . 0.517 ' ND2' ' O ' ' A' ' 111' ' ' SER . 4.0 t-20 -123.06 132.18 24.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 107.726 -1.213 . . . . 51.77 107.726 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -43.62 -31.44 3.27 Favored 'Trans proline' 0 C--N 1.329 -0.466 0 C-N-CA 122.315 2.01 . . . . 51.08 114.942 -179.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 109' ' ' SER . 0.4 OUTLIER -84.19 25.65 0.82 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 112.484 0.55 . . . . 69.24 112.484 -178.867 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 86.42 -32.44 3.89 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 119.243 2.457 . . . . 56.5 119.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.06 150.92 36.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.861 1.331 . . . . 66.5 112.302 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -148.76 137.14 21.12 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 115.197 1.554 . . . . 51.6 115.197 -179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.4 mt -117.52 170.54 8.66 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.705 1.372 . . . . 45.0 114.705 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -130.91 114.8 15.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.587 -1.264 . . . . 45.77 107.587 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLU . . . . . 0.531 ' O ' ' C ' ' A' ' 165' ' ' SER . 2.2 mt-10 -130.97 150.48 52.1 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 112.191 0.441 . . . . 60.53 112.191 -179.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' SER . . . . . 0.531 ' C ' ' O ' ' A' ' 164' ' ' GLU . 0.3 OUTLIER -29.56 125.06 0.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.461 -0.496 . . . . 51.12 112.131 -179.592 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' CYS . . . . . . . . . . . . . 50.5 m -57.66 -4.94 0.31 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.88 -0.415 . . . . 50.95 109.88 178.472 -76.462 -70.982 104.297 102.323 2.026 102.673 60.766 -85.056 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' GLU . . . . . 0.454 ' N ' ' C ' ' A' ' 165' ' ' SER . 2.2 mm-40 -106.9 11.76 29.6 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.485 0.921 . . . . 55.66 113.485 -179.627 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.74 -171.18 2.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.415 -0.957 . . . . 55.28 108.415 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -132.02 81.21 1.95 Allowed 'General case' 0 C--O 1.244 0.779 0 N-CA-C 114.769 1.396 . . . . 55.05 114.769 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -103.68 177.86 4.72 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.193 -0.912 . . . . 51.06 109.034 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ARG . . . . . 0.425 ' O ' ' N ' ' A' ' 116' ' ' TRP . 7.6 mtt180 -86.93 164.5 16.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.356 -0.609 . . . . 64.16 109.356 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -122.32 167.26 13.48 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.471 -1.292 . . . . 34.17 114.187 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ILE . . . . . . . . . . . . . 80.6 mt -140.32 113.28 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.15 -0.932 . . . . 26.97 110.593 179.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' CYS . . . . . . . . . . . . . 3.6 m -100.83 163.1 12.47 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.748 -1.945 . . . . 28.07 105.748 178.563 -38.458 -66.587 -71.956 101.837 2.027 102.951 -54.332 -68.514 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -153.77 120.06 5.46 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 119.691 -0.804 . . . . 32.24 112.548 179.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -85.87 128.52 34.84 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 103.434 -2.802 . . . . 54.48 103.434 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -109.03 -34.21 6.68 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 120.335 3.457 . . . . 63.94 120.335 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 14.1 mt -138.99 131.34 28.43 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.705 -0.622 . . . . 72.01 111.238 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.34 0 CA-C-O 118.509 -0.758 . . . . 75.97 112.66 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . 0.417 ' O ' ' NZ ' ' A' ' 80' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . 0.475 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . 0.429 ' O ' ' NE2' ' A' ' 92' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.259 0.552 . . . . 63.3 110.024 . -49.922 -126.204 -87.907 103.338 2.036 106.953 72.817 -160.927 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 p -64.06 151.91 41.75 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.975 -0.557 . . . . 61.49 112.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 25.1 m -127.44 174.86 8.67 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.79 -0.641 . . . . 57.22 112.468 179.766 -48.949 -87.895 -77.975 103.287 2.025 105.136 -80.187 -52.094 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . 0.491 ' O ' ' O ' ' A' ' 63' ' ' GLU . 41.6 mm-40 -71.84 176.76 4.68 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.495 0.554 . . . . 77.01 112.495 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 62' ' ' GLN . 1.0 OUTLIER -27.45 -115.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 117.916 2.561 . . . . 74.04 117.916 -179.085 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' H ' ' HB3' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.75 46.77 0.07 Allowed 'General case' 0 C--O 1.232 0.164 0 N-CA-C 115.131 1.53 . . . . 61.61 115.131 -178.275 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TRP . . . . . 0.642 ' CZ3' ' HB2' ' A' ' 74' ' ' PHE . 48.5 m95 -111.75 147.89 34.69 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 107.769 -1.197 . . . . 54.14 107.769 179.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -110.01 125.11 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.444 0.905 . . . . 36.28 113.444 -178.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -91.45 135.36 12.75 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 117.655 1.822 . . . . 29.36 117.655 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . 0.466 ' C ' ' HG2' ' A' ' 69' ' ' ARG . 13.9 t80 -158.04 144.5 17.56 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.631 -0.877 . . . . 40.38 108.631 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . 0.65 ' NH1' ' HA ' ' A' ' 104' ' ' GLU . 5.3 ptp180 41.99 47.47 3.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.936 -0.574 . . . . 62.56 109.825 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.2 t 46.93 51.75 12.39 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.633 0.73 . . . . 55.74 110.515 -179.491 -160.927 72.817 -87.907 106.953 2.036 103.338 -126.204 -49.922 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -146.05 147.96 32.17 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 107.564 -1.272 . . . . 48.26 107.564 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' CYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 175' ' ' LYS . 38.2 m -109.6 129.59 55.57 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.371 -0.931 . . . . 43.32 109.815 178.565 -52.094 -80.187 -77.975 105.136 2.025 103.287 -87.895 -48.949 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . 0.44 ' CE2' ' HD2' ' A' ' 175' ' ' LYS . 96.9 m-85 -118.96 151.69 37.73 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 30.52 109.21 -179.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PHE . . . . . 0.642 ' HB2' ' CZ3' ' A' ' 65' ' ' TRP . 43.3 t80 -127.46 115.2 18.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 106.625 -1.621 . . . . 27.37 106.625 176.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.682 HD12 ' SD ' ' A' ' 108' ' ' MET . 0.0 OUTLIER -112.14 88.57 1.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-O 121.489 0.661 . . . . 30.58 110.067 -179.498 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 171' ' ' ARG . 9.9 p -50.55 153.59 1.58 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 117.938 2.57 . . . . 32.65 117.938 -178.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.24 -41.71 7.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 107.455 -1.313 . . . . 41.61 107.455 177.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.5 153.96 37.39 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 112.631 0.604 . . . . 65.19 112.631 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 169' ' ' LYS . 0.0 OUTLIER -106.66 126.83 52.78 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 106.605 -1.628 . . . . 53.75 106.605 177.868 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . 0.541 ' O ' ' HA ' ' A' ' 169' ' ' LYS . 7.7 mmmt -133.58 -171.23 2.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 114.345 1.239 . . . . 40.25 114.345 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . 0.722 ' CB ' ' HG3' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -89.22 154.52 20.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.137 -1.801 . . . . 44.47 106.137 178.617 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' TRP . . . . . 0.7 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 10.7 t90 -64.62 -29.87 70.88 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.279 0.474 . . . . 35.69 112.279 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -80.43 -23.6 40.21 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 118.283 -1.367 . . . . 38.15 109.744 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . 0.722 ' HG3' ' CB ' ' A' ' 81' ' ' THR . 3.1 mt-10 -72.97 -63.85 1.09 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.552 0.692 . . . . 43.95 109.549 178.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . 0.496 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.1 OUTLIER -47.2 -47.5 24.19 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.026 -1.842 . . . . 31.95 106.026 179.723 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' O ' ' A' ' 82' ' ' TRP . 1.3 ttp180 -45.06 -43.32 9.37 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.659 -1.155 . . . . 34.37 109.464 178.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 91' ' ' SER . 7.9 m80 -81.69 -34.96 30.37 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.591 -1.186 . . . . 31.95 112.528 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . 0.551 HD12 ' C ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.81 -44.58 95.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 118.808 -1.157 . . . . 36.23 109.767 -179.169 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 92.6 m -62.32 -47.36 84.6 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 108.602 -0.888 . . . . 30.23 108.602 179.919 -68.514 -54.332 -71.956 102.951 2.027 101.837 -66.587 -38.458 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.17 74.68 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 107.835 -1.172 . . . . 30.31 107.835 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 87' ' ' HIS . 0.3 OUTLIER -60.73 -32.69 71.94 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.623 -1.172 . . . . 37.91 108.019 -179.547 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -101.67 38.36 1.63 Allowed 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 115.5 1.667 . . . . 40.86 115.5 -178.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.82 29.04 2.11 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.715 1.006 . . . . 57.04 113.715 179.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . 0.452 ' OG ' ' HB3' ' A' ' 174' ' ' CYS . 63.0 p -129.14 -154.41 0.63 Allowed 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 106.194 -1.78 . . . . 29.46 106.194 178.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.8 p -173.55 143.52 1.04 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.266 1.951 . . . . 23.14 116.266 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.56 ' O ' ' HA3' ' A' ' 118' ' ' GLY . 6.1 tp -43.17 92.32 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.778 2.14 . . . . 29.33 116.778 -178.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.3 tp 1.28 117.57 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 1 N-CA-C 124.076 4.843 . . . . 22.63 124.076 179.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . 0.53 ' HA ' ' CE3' ' A' ' 130' ' ' TRP . 29.1 tt0 -113.33 109.62 19.02 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 103.161 -2.903 . . . . 42.98 103.161 176.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 13.7 mt -69.53 112.86 6.32 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.833 1.049 . . . . 29.91 113.833 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' ' 101' ' ' ASN . 51.1 mm-40 -77.98 -4.8 48.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.37 -0.604 . . . . 45.1 109.37 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 100' ' ' GLN . 13.5 p30 160.38 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.057 1.743 . . . . 39.45 112.116 177.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 22' ' ' HOH . 0.0 OUTLIER -44.75 -26.96 0.44 Allowed 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 114.664 1.357 . . . . 39.84 114.664 -178.064 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.93 44.55 1.02 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.008 1.114 . . . . 52.74 114.008 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 69' ' ' ARG . 2.2 tt0 -91.59 -23.5 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.353 -0.539 . . . . 40.26 111.058 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 0.782 ' HB3' ' HE2' ' A' ' 108' ' ' MET . 8.0 mt -117.03 44.2 2.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.04 1.126 . . . . 39.54 114.04 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 109' ' ' SER . 1.3 m-20 -38.16 -55.72 1.26 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.351 0.661 . . . . 45.4 110.98 179.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . 0.589 ' C ' ' H ' ' A' ' 109' ' ' SER . 36.3 p90 -51.36 -59.87 3.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 113.819 1.044 . . . . 44.25 113.819 -177.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' MET . . . . . 0.782 ' HE2' ' HB3' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.62 3.35 0.03 OUTLIER 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.323 0.583 . . . . 53.02 111.278 -179.683 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . 0.642 ' HB2' ' O ' ' A' ' 106' ' ' ASP . 30.8 t -10.23 -36.0 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 120.818 3.636 . . . . 57.81 120.818 -179.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 108' ' ' MET . 0.2 OUTLIER -111.66 -38.02 5.01 Favored 'General case' 0 C--N 1.327 -0.381 1 N-CA-C 122.138 4.125 . . . . 62.44 122.138 -176.541 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . 0.517 ' O ' ' ND2' ' A' ' 156' ' ' ASN . 0.1 OUTLIER -17.78 109.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 115.773 1.768 . . . . 65.36 115.773 -179.534 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.1 38.0 0.64 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.325 0.583 . . . . 76.5 110.959 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . 0.471 HE22 ' NH1' ' A' ' 171' ' ' ARG . 7.0 pt20 -131.53 150.66 52.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.464 -0.939 . . . . 59.04 108.464 179.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . 0.458 ' HE2' ' HA ' ' A' ' 161' ' ' ALA . 47.3 m-85 -92.87 167.69 11.67 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.739 -0.784 . . . . 49.13 112.839 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . 0.539 ' O ' ' HA ' ' A' ' 154' ' ' ALA . 74.4 m-85 -137.98 161.84 35.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.576 -0.898 . . . . 38.94 108.576 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TRP . . . . . 0.495 ' HA ' ' CE3' ' A' ' 116' ' ' TRP . 0.0 OUTLIER -83.55 146.09 28.52 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.88 -2.267 . . . . 43.1 104.88 179.708 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 155' ' ' TYR . 0.2 OUTLIER -140.88 159.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 119.664 -0.814 . . . . 30.47 109.07 176.166 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . 0.56 ' HA3' ' O ' ' A' ' 96' ' ' LEU . . . -66.42 18.53 0.21 Allowed Glycine 0 C--N 1.331 0.303 0 N-CA-C 122.451 3.74 . . . . 30.45 122.451 -176.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . 0.938 HD23 HG13 ' A' ' 153' ' ' ILE . 12.9 tp -98.07 132.1 43.9 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.608 -0.516 . . . . 30.98 109.608 -179.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.01 150.66 29.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.923 -0.769 . . . . 33.13 108.923 -179.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TYR . . . . . 0.503 ' CD1' HG22 ' A' ' 149' ' ' THR . 38.7 t80 -70.28 165.96 21.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.207 -0.997 . . . . 32.26 111.71 -179.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . 0.422 ' N ' ' CD2' ' A' ' 121' ' ' TYR . 1.7 t -155.77 93.9 1.51 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.463 0.649 . . . . 31.44 111.29 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -52.71 -26.68 14.71 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.771 -1.104 . . . . 50.23 113.156 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 124' ' ' GLU . 77.2 tt0 -65.07 -30.29 71.23 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 117.552 -1.659 . . . . 38.54 113.849 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HIS . . . . . 0.472 ' O ' ' C ' ' A' ' 126' ' ' THR . 6.0 m80 -118.77 19.36 13.16 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.948 -0.76 . . . . 34.29 108.948 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 125' ' ' HIS . 0.8 OUTLIER 28.09 72.88 0.04 OUTLIER 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 107.78 -1.192 . . . . 28.93 107.78 -176.766 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -174.84 159.41 2.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.651 0.595 . . . . 27.17 110.476 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' TRP . . . . . 0.788 ' CZ2' ' HB3' ' A' ' 147' ' ' PHE . 82.4 m95 -88.14 137.47 32.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 103.007 -2.961 . . . . 31.41 103.007 177.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 128' ' ' TRP . 21.3 mt -129.31 155.78 45.06 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 114.861 1.43 . . . . 23.44 114.861 -179.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' TRP . . . . . 0.53 ' CE3' ' HA ' ' A' ' 98' ' ' GLN . 98.6 m95 -86.63 -176.29 5.76 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 104.159 -2.534 . . . . 26.78 104.159 177.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 36' ' ' HOH . 10.8 mm-40 -65.51 -33.77 76.71 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 118.218 -1.393 . . . . 31.53 113.138 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 39.7 p30 -88.82 12.96 13.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 114.184 1.179 . . . . 22.71 114.184 -178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 84.61 13.09 73.72 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 119.201 2.44 . . . . 20.24 119.201 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.5 140.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 105.055 -2.202 . . . . 25.04 105.055 178.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.15 159.26 33.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 120.558 -0.457 . . . . 32.23 110.049 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . 0.845 HD22 HD21 ' A' ' 119' ' ' LEU . 11.2 tp -81.47 129.95 34.85 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.807 -0.812 . . . . 34.41 108.807 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 t -65.66 132.41 48.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 118.479 -1.289 . . . . 38.55 109.479 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -63.66 -23.22 67.28 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 116.817 2.154 . . . . 41.63 116.817 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -99.07 -1.41 39.66 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.635 -0.426 . . . . 44.18 111.647 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . 0.492 HD12 ' N ' ' A' ' 141' ' ' PHE . 0.1 OUTLIER -64.23 -88.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 101.196 -3.631 . . . . 45.34 101.196 178.892 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 141' ' ' PHE . . . . . 0.492 ' N ' HD12 ' A' ' 140' ' ' LEU . 61.0 m-85 -75.57 137.63 70.75 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.477 -0.934 . . . . 54.99 108.477 179.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' O ' ' N ' ' A' ' 144' ' ' PHE . 36.4 Cg_endo -82.3 -58.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 120.74 0.96 . . . . 55.24 110.682 -179.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' SER . . . . . 0.89 ' O ' HG22 ' A' ' 146' ' ' THR . 0.0 OUTLIER -35.54 -33.89 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.543 -0.753 . . . . 55.4 109.96 178.677 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PHE . . . . . 0.498 ' C ' ' O ' ' A' ' 143' ' ' SER . 1.4 t80 13.03 -96.08 0.0 OUTLIER 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.325 0.861 . . . . 59.89 113.325 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -34.35 -20.8 0.0 OUTLIER 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.503 2.038 . . . . 61.91 116.503 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 143' ' ' SER . 2.0 t -76.19 -50.11 15.4 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.453 -0.499 . . . . 65.02 110.488 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PHE . . . . . 0.788 ' HB3' ' CZ2' ' A' ' 128' ' ' TRP . 16.4 m-30 -25.4 108.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 116.07 1.878 . . . . 58.56 116.07 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASN . . . . . 0.636 ' O ' ' N ' ' A' ' 150' ' ' LYS . 53.0 t30 -76.36 102.22 5.83 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 119.745 -0.782 . . . . 56.9 110.771 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . 0.503 HG22 ' CD1' ' A' ' 121' ' ' TYR . 40.7 p -31.13 -16.77 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 117.635 2.457 . . . . 45.37 117.635 -177.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 148' ' ' ASN . 4.8 mtpp -94.45 17.1 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 119.175 -1.01 . . . . 46.68 110.404 178.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ASN . . . . . 0.599 ' OD1' ' HB3' ' A' ' 148' ' ' ASN . 30.2 m120 -123.95 168.92 12.16 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.357 1.614 . . . . 47.79 115.357 -178.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' CYS . . . . . 0.577 ' SG ' ' CG ' ' A' ' 82' ' ' TRP . 6.8 m -99.41 167.0 10.91 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.679 -1.23 . . . . 46.25 107.679 177.618 -85.056 60.766 104.297 102.673 2.026 102.323 -70.982 -76.462 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ILE . . . . . 0.938 HG13 HD23 ' A' ' 119' ' ' LEU . 25.5 mm -105.52 125.42 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 C-N-CA 119.13 -1.028 . . . . 48.82 112.332 -179.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 115' ' ' TYR . . . -107.08 147.92 29.4 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 102.619 -3.104 . . . . 44.28 102.619 177.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' TYR . . . . . 0.44 ' HB3' HG21 ' A' ' 117' ' ' ILE . 79.9 t80 -134.4 156.05 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.736 0.779 . . . . 44.88 112.61 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ASN . . . . . 0.517 ' ND2' ' O ' ' A' ' 111' ' ' SER . 4.0 t-20 -123.06 132.18 24.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 107.726 -1.213 . . . . 51.77 107.726 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' PRO . . . . . 0.548 ' HG3' ' HE3' ' A' ' 108' ' ' MET . 97.2 Cg_exo -43.62 -31.44 3.27 Favored 'Trans proline' 0 C--N 1.329 -0.466 0 C-N-CA 122.315 2.01 . . . . 51.08 114.942 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 109' ' ' SER . 0.4 OUTLIER -84.19 25.65 0.82 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 112.484 0.55 . . . . 69.24 112.484 -178.867 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 86.42 -32.44 3.89 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 119.243 2.457 . . . . 56.5 119.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.06 150.92 36.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.861 1.331 . . . . 66.5 112.302 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . 0.458 ' HA ' ' HE2' ' A' ' 114' ' ' PHE . . . -148.76 137.14 21.12 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 115.197 1.554 . . . . 51.6 115.197 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.4 mt -117.52 170.54 8.66 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.705 1.372 . . . . 45.0 114.705 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -130.91 114.8 15.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.587 -1.264 . . . . 45.77 107.587 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLU . . . . . 0.531 ' O ' ' C ' ' A' ' 165' ' ' SER . 2.2 mt-10 -130.97 150.48 52.1 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 112.191 0.441 . . . . 60.53 112.191 -179.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' SER . . . . . 0.531 ' C ' ' O ' ' A' ' 164' ' ' GLU . 0.3 OUTLIER -29.56 125.06 0.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.461 -0.496 . . . . 51.12 112.131 -179.592 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 166' ' ' CYS . . . . . . . . . . . . . 50.5 m -57.66 -4.94 0.31 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.88 -0.415 . . . . 50.95 109.88 178.472 -76.462 -70.982 104.297 102.323 2.026 102.673 60.766 -85.056 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' GLU . . . . . 0.527 ' HA ' ' CG2' ' A' ' 81' ' ' THR . 2.2 mm-40 -106.9 11.76 29.6 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.485 0.921 . . . . 55.66 113.485 -179.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.74 -171.18 2.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.415 -0.957 . . . . 55.28 108.415 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 80' ' ' LYS . 14.5 mttt -132.02 81.21 1.95 Allowed 'General case' 0 C--O 1.244 0.779 0 N-CA-C 114.769 1.396 . . . . 55.05 114.769 -179.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -103.68 177.86 4.72 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.193 -0.912 . . . . 51.06 109.034 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ARG . . . . . 0.471 ' NH1' HE22 ' A' ' 113' ' ' GLN . 7.6 mtt180 -86.93 164.5 16.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.356 -0.609 . . . . 64.16 109.356 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -122.32 167.26 13.48 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.471 -1.292 . . . . 34.17 114.187 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ILE . . . . . 0.618 HG12 HG23 ' A' ' 75' ' ' ILE . 80.6 mt -140.32 113.28 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.15 -0.932 . . . . 26.97 110.593 179.173 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' CYS . . . . . 0.452 ' HB3' ' OG ' ' A' ' 94' ' ' SER . 3.6 m -100.83 163.1 12.47 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.748 -1.945 . . . . 28.07 105.748 178.563 -38.458 -66.587 -71.956 101.837 2.027 102.951 -54.332 -68.514 2 2 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 72' ' ' CYS . 0.1 OUTLIER -153.77 120.06 5.46 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 119.691 -0.804 . . . . 32.24 112.548 179.578 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -85.87 128.52 34.84 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 103.434 -2.802 . . . . 54.48 103.434 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -109.03 -34.21 6.68 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 120.335 3.457 . . . . 63.94 120.335 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 14.1 mt -138.99 131.34 28.43 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.705 -0.622 . . . . 72.01 111.238 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.34 0 CA-C-O 118.509 -0.758 . . . . 75.97 112.66 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HOH . . . . . 0.438 ' O ' ' HB3' ' A' ' 69' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . 0.425 ' O ' ' NE2' ' A' ' 62' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . 0.538 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . 0.601 ' O ' ' HE2' ' A' ' 150' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . 0.661 ' O ' ' HA ' ' A' ' 81' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . 0.447 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.259 0.552 . . . . 63.299999999999997 110.024 . -49.922 -126.204 -87.907 103.338 2.036 106.953 72.817 -160.927 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 10.9 p -64.06 151.91 41.75 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.975 -0.557 . . . . 61.490000000000002 112.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 25.1 m -127.44 174.86 8.67 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.79 -0.641 . . . . 57.219999999999999 112.468 179.766 -48.949 -87.895 -77.975 103.287 2.025 105.136 -80.187 -52.094 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.491 ' O ' ' O ' ' A' ' 63' ' ' GLU . 2.6 mm100 -71.84 176.76 4.68 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.495 0.554 . . . . 77.010000000000005 112.495 179.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.491 ' O ' ' O ' ' A' ' 62' ' ' GLN . 1.0 OUTLIER -27.45 -115.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 117.916 2.561 . . . . 74.040000000000006 117.916 -179.085 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' H ' ' HB3' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.75 46.77 0.07 Allowed 'General case' 0 C--O 1.232 0.164 0 N-CA-C 115.131 1.53 . . . . 61.609999999999999 115.131 -178.275 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.642 ' CZ3' ' HB2' ' A' ' 74' ' ' PHE . 48.5 m95 -111.75 147.89 34.69 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 107.769 -1.197 . . . . 54.140000000000001 107.769 179.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -110.01 125.11 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 N-CA-C 113.444 0.905 . . . . 36.280000000000001 113.444 -178.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -91.45 135.36 12.75 Favored Glycine 0 CA--C 1.525 0.708 0 N-CA-C 117.655 1.822 . . . . 29.359999999999999 117.655 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.466 ' C ' ' HG2' ' A' ' 69' ' ' ARG . 13.9 t80 -158.04 144.5 17.56 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 108.631 -0.877 . . . . 40.380000000000003 108.631 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.65 ' NH1' ' HA ' ' A' ' 104' ' ' GLU . 5.3 ptp180 41.99 47.47 3.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.936 -0.574 . . . . 62.560000000000002 109.825 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.2 t 46.93 51.75 12.39 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.633 0.73 . . . . 55.740000000000002 110.515 -179.491 -160.927 72.817 -87.907 106.953 2.036 103.338 -126.204 -49.922 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -146.05 147.96 32.17 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 107.564 -1.272 . . . . 48.259999999999998 107.564 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 175' ' ' LYS . 38.2 m -109.6 129.59 55.57 Favored 'General case' 0 CA--C 1.505 -0.762 0 C-N-CA 119.371 -0.931 . . . . 43.32 109.815 178.565 -52.094 -80.187 -77.975 105.136 2.025 103.287 -87.895 -48.949 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.44 ' CE2' ' HD2' ' A' ' 175' ' ' LYS . 96.9 m-85 -118.96 151.69 37.73 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.246 -0.888 . . . . 30.52 109.21 -179.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.642 ' HB2' ' CZ3' ' A' ' 65' ' ' TRP . 43.3 t80 -127.46 115.2 18.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 106.625 -1.621 . . . . 27.370000000000001 106.625 176.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.682 HD12 ' SD ' ' A' ' 108' ' ' MET . 0.0 OUTLIER -112.14 88.57 1.14 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-O 121.489 0.661 . . . . 30.579999999999998 110.067 -179.498 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 171' ' ' ARG . 9.9 p -50.55 153.59 1.58 Allowed 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 117.938 2.57 . . . . 32.649999999999999 117.938 -178.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.24 -41.71 7.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 107.455 -1.313 . . . . 41.609999999999999 107.455 177.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.5 153.96 37.39 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 112.631 0.604 . . . . 65.189999999999998 112.631 -179.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 169' ' ' LYS . 0.0 OUTLIER -106.66 126.83 52.78 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 106.605 -1.628 . . . . 53.75 106.605 177.868 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.541 ' O ' ' HA ' ' A' ' 169' ' ' LYS . 7.7 mmmt -133.58 -171.23 2.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 114.345 1.239 . . . . 40.25 114.345 -178.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . 0.722 ' CB ' ' HG3' ' A' ' 84' ' ' GLU . 0.3 OUTLIER -89.22 154.52 20.06 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.137 -1.801 . . . . 44.469999999999999 106.137 178.617 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' TRP . . . . . 0.7 ' O ' ' HB2' ' A' ' 86' ' ' ARG . 10.7 t90 -64.62 -29.87 70.88 Favored 'General case' 0 C--O 1.243 0.717 0 N-CA-C 112.279 0.474 . . . . 35.689999999999998 112.279 -179.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -80.43 -23.6 40.21 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 118.283 -1.367 . . . . 38.149999999999999 109.744 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.722 ' HG3' ' CB ' ' A' ' 81' ' ' THR . 3.1 mt-10 -72.97 -63.85 1.09 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.552 0.692 . . . . 43.950000000000003 109.549 178.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . 0.496 ' HA ' HD12 ' A' ' 88' ' ' LEU . 0.1 OUTLIER -47.2 -47.5 24.19 Favored 'General case' 0 CA--C 1.497 -1.078 0 N-CA-C 106.026 -1.842 . . . . 31.949999999999999 106.026 179.723 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.7 ' HB2' ' O ' ' A' ' 82' ' ' TRP . 1.3 ttp180 -45.06 -43.32 9.37 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.659 -1.155 . . . . 34.369999999999997 109.464 178.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 91' ' ' SER . 7.9 m80 -81.69 -34.96 30.37 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 114.591 -1.186 . . . . 31.949999999999999 112.528 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.551 HD12 ' C ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.81 -44.58 95.78 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 118.808 -1.157 . . . . 36.229999999999997 109.767 -179.169 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 92.6 m -62.32 -47.36 84.6 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 108.602 -0.888 . . . . 30.23 108.602 179.919 -68.514 -54.332 -71.956 102.951 2.027 101.837 -66.587 -38.458 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.17 74.68 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 107.835 -1.172 . . . . 30.309999999999999 107.835 -179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . 0.401 ' HB3' ' O ' ' A' ' 87' ' ' HIS . 0.3 OUTLIER -60.73 -32.69 71.94 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.623 -1.172 . . . . 37.909999999999997 108.019 -179.547 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -101.67 38.36 1.63 Allowed 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 115.5 1.667 . . . . 40.859999999999999 115.5 -178.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.82 29.04 2.11 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 113.715 1.006 . . . . 57.039999999999999 113.715 179.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . 0.452 ' OG ' ' HB3' ' A' ' 174' ' ' CYS . 63.0 p -129.14 -154.41 0.63 Allowed 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 106.194 -1.78 . . . . 29.460000000000001 106.194 178.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 92.8 p -173.55 143.52 1.04 Allowed 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 116.266 1.951 . . . . 23.140000000000001 116.266 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.56 ' O ' ' HA3' ' A' ' 118' ' ' GLY . 6.1 tp -43.17 92.32 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 116.778 2.14 . . . . 29.329999999999998 116.778 -178.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 12.3 tp 1.28 117.57 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.65 1 N-CA-C 124.076 4.843 . . . . 22.629999999999999 124.076 179.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.53 ' HA ' ' CE3' ' A' ' 130' ' ' TRP . 4.5 tt0 -113.33 109.62 19.02 Favored 'General case' 0 C--O 1.246 0.89 0 N-CA-C 103.161 -2.903 . . . . 42.979999999999997 103.161 176.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 13.7 mt -69.53 112.86 6.32 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.833 1.049 . . . . 29.91 113.833 -178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' A' ' 101' ' ' ASN . 51.1 mm-40 -77.98 -4.8 48.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.37 -0.604 . . . . 45.100000000000001 109.37 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 100' ' ' GLN . 13.5 p30 160.38 152.03 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.057 1.743 . . . . 39.450000000000003 112.116 177.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . 0.538 ' HB ' ' O ' ' A' ' 22' ' ' HOH . 0.0 OUTLIER -44.75 -26.96 0.44 Allowed 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 114.664 1.357 . . . . 39.840000000000003 114.664 -178.064 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.93 44.55 1.02 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.008 1.114 . . . . 52.740000000000002 114.008 -178.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.65 ' HA ' ' NH1' ' A' ' 69' ' ' ARG . 2.2 tt0 -91.59 -23.5 19.87 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.353 -0.539 . . . . 40.259999999999998 111.058 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.782 ' HB3' ' HE2' ' A' ' 108' ' ' MET . 8.0 mt -117.03 44.2 2.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 114.04 1.126 . . . . 39.539999999999999 114.04 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 109' ' ' SER . 1.3 m-20 -38.16 -55.72 1.26 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.351 0.661 . . . . 45.399999999999999 110.98 179.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.589 ' C ' ' H ' ' A' ' 109' ' ' SER . 36.3 p90 -51.36 -59.87 3.75 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 113.819 1.044 . . . . 44.25 113.819 -177.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' MET . . . . . 0.782 ' HE2' ' HB3' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -58.62 3.35 0.03 OUTLIER 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.323 0.583 . . . . 53.020000000000003 111.278 -179.683 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . 0.642 ' HB2' ' O ' ' A' ' 106' ' ' ASP . 30.8 t -10.23 -36.0 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 120.818 3.636 . . . . 57.810000000000002 120.818 -179.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . 0.619 ' N ' ' O ' ' A' ' 108' ' ' MET . 0.2 OUTLIER -111.66 -38.02 5.01 Favored 'General case' 0 C--N 1.327 -0.381 1 N-CA-C 122.138 4.125 . . . . 62.439999999999998 122.138 -176.541 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . 0.517 ' O ' ' ND2' ' A' ' 156' ' ' ASN . 0.1 OUTLIER -17.78 109.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 115.773 1.768 . . . . 65.359999999999999 115.773 -179.534 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.1 38.0 0.64 Allowed 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.325 0.583 . . . . 76.5 110.959 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.471 HE22 ' NH1' ' A' ' 171' ' ' ARG . 7.0 pt20 -131.53 150.66 52.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 108.464 -0.939 . . . . 59.039999999999999 108.464 179.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . 0.458 ' HE2' ' HA ' ' A' ' 161' ' ' ALA . 47.3 m-85 -92.87 167.69 11.67 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.739 -0.784 . . . . 49.130000000000003 112.839 -179.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.539 ' O ' ' HA ' ' A' ' 154' ' ' ALA . 74.4 m-85 -137.98 161.84 35.66 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.576 -0.898 . . . . 38.939999999999998 108.576 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.495 ' CE3' ' HA ' ' A' ' 116' ' ' TRP . 0.0 OUTLIER -83.55 146.09 28.52 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 104.88 -2.267 . . . . 43.100000000000001 104.88 179.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 155' ' ' TYR . 0.2 OUTLIER -140.88 159.28 23.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 119.664 -0.814 . . . . 30.469999999999999 109.07 176.166 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.56 ' HA3' ' O ' ' A' ' 96' ' ' LEU . . . -66.42 18.53 0.21 Allowed Glycine 0 C--N 1.331 0.303 0 N-CA-C 122.451 3.74 . . . . 30.449999999999999 122.451 -176.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.938 HD23 HG13 ' A' ' 153' ' ' ILE . 12.9 tp -98.07 132.1 43.9 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.608 -0.516 . . . . 30.98 109.608 -179.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -153.01 150.66 29.42 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.923 -0.769 . . . . 33.130000000000003 108.923 -179.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.503 ' CD1' HG22 ' A' ' 149' ' ' THR . 38.7 t80 -70.28 165.96 21.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.207 -0.997 . . . . 32.259999999999998 111.71 -179.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . 0.422 ' N ' ' CD2' ' A' ' 121' ' ' TYR . 1.7 t -155.77 93.9 1.51 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.463 0.649 . . . . 31.440000000000001 111.29 179.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -52.71 -26.68 14.71 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-N 114.771 -1.104 . . . . 50.229999999999997 113.156 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 124' ' ' GLU . 77.2 tt0 -65.07 -30.29 71.23 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 117.552 -1.659 . . . . 38.539999999999999 113.849 -178.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.472 ' O ' ' C ' ' A' ' 126' ' ' THR . 6.0 m80 -118.77 19.36 13.16 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.948 -0.76 . . . . 34.289999999999999 108.948 178.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 125' ' ' HIS . 0.8 OUTLIER 28.09 72.88 0.04 OUTLIER 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 107.78 -1.192 . . . . 28.93 107.78 -176.766 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -174.84 159.41 2.75 Favored 'General case' 0 N--CA 1.441 -0.88 0 O-C-N 123.651 0.595 . . . . 27.170000000000002 110.476 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' TRP . . . . . 0.788 ' CZ2' ' HB3' ' A' ' 147' ' ' PHE . 82.4 m95 -88.14 137.47 32.3 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 103.007 -2.961 . . . . 31.41 103.007 177.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.609 HD23 ' O ' ' A' ' 128' ' ' TRP . 21.3 mt -129.31 155.78 45.06 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 114.861 1.43 . . . . 23.440000000000001 114.861 -179.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' TRP . . . . . 0.53 ' CE3' ' HA ' ' A' ' 98' ' ' GLN . 98.6 m95 -86.63 -176.29 5.76 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 104.159 -2.534 . . . . 26.780000000000001 104.159 177.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' A' ' 36' ' ' HOH . 10.8 mm-40 -65.51 -33.77 76.71 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 118.218 -1.393 . . . . 31.530000000000001 113.138 -179.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.452 HD22 ' C ' ' A' ' 132' ' ' ASN . 0.1 OUTLIER -88.82 12.96 13.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 114.184 1.179 . . . . 22.710000000000001 114.184 -178.664 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 84.61 13.09 73.72 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 119.201 2.44 . . . . 20.239999999999998 119.201 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.5 140.18 29.79 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 105.055 -2.202 . . . . 25.039999999999999 105.055 178.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.15 159.26 33.28 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 120.558 -0.457 . . . . 32.229999999999997 110.049 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.845 HD22 HD21 ' A' ' 119' ' ' LEU . 11.2 tp -81.47 129.95 34.85 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.807 -0.812 . . . . 34.409999999999997 108.807 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 1.7 t -65.66 132.41 48.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 118.479 -1.289 . . . . 38.549999999999997 109.479 179.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -63.66 -23.22 67.28 Favored 'General case' 0 C--O 1.221 -0.417 0 N-CA-C 116.817 2.154 . . . . 41.630000000000003 116.817 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -99.07 -1.41 39.66 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.635 -0.426 . . . . 44.18 111.647 179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.492 HD12 ' N ' ' A' ' 141' ' ' PHE . 0.1 OUTLIER -64.23 -88.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 101.196 -3.631 . . . . 45.340000000000003 101.196 178.892 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.492 ' N ' HD12 ' A' ' 140' ' ' LEU . 61.0 m-85 -75.57 137.63 70.75 Favored Pre-proline 0 CA--C 1.54 0.568 0 N-CA-C 108.477 -0.934 . . . . 54.990000000000002 108.477 179.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PRO . . . . . 0.435 ' O ' ' N ' ' A' ' 144' ' ' PHE . 36.4 Cg_endo -82.3 -58.61 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 120.74 0.96 . . . . 55.240000000000002 110.682 -179.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' SER . . . . . 0.89 ' O ' HG22 ' A' ' 146' ' ' THR . 0.0 OUTLIER -35.54 -33.89 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.543 -0.753 . . . . 55.399999999999999 109.96 178.677 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PHE . . . . . 0.498 ' C ' ' O ' ' A' ' 143' ' ' SER . 1.4 t80 13.03 -96.08 0.0 OUTLIER 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.325 0.861 . . . . 59.890000000000001 113.325 179.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -34.35 -20.8 0.0 OUTLIER 'General case' 0 C--O 1.236 0.386 0 N-CA-C 116.503 2.038 . . . . 61.909999999999997 116.503 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 143' ' ' SER . 2.0 t -76.19 -50.11 15.4 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 120.453 -0.499 . . . . 65.019999999999996 110.488 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.788 ' HB3' ' CZ2' ' A' ' 128' ' ' TRP . 16.4 m-30 -25.4 108.34 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 116.07 1.878 . . . . 58.560000000000002 116.07 -179.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASN . . . . . 0.749 ' HB3' ' ND2' ' A' ' 151' ' ' ASN . 2.2 t-20 -76.36 102.22 5.83 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 119.745 -0.782 . . . . 56.899999999999999 110.771 178.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . 0.503 HG22 ' CD1' ' A' ' 121' ' ' TYR . 40.7 p -31.13 -16.77 0.0 OUTLIER 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 117.635 2.457 . . . . 45.369999999999997 117.635 -177.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.636 ' N ' ' O ' ' A' ' 148' ' ' ASN . 4.8 mtpp -94.45 17.1 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 119.175 -1.01 . . . . 46.68 110.404 178.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ASN . . . . . 0.749 ' ND2' ' HB3' ' A' ' 148' ' ' ASN . 77.0 m-20 -123.95 168.92 12.16 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 115.357 1.614 . . . . 47.789999999999999 115.357 -178.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' CYS . . . . . 0.577 ' SG ' ' CG ' ' A' ' 82' ' ' TRP . 6.8 m -99.41 167.0 10.91 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.679 -1.23 . . . . 46.25 107.679 177.618 -85.056 60.766 104.297 102.673 2.026 102.323 -70.982 -76.462 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ILE . . . . . 0.938 HG13 HD23 ' A' ' 119' ' ' LEU . 25.5 mm -105.52 125.42 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.002 0 C-N-CA 119.13 -1.028 . . . . 48.82 112.332 -179.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' ' 115' ' ' TYR . . . -107.08 147.92 29.4 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 102.619 -3.104 . . . . 44.280000000000001 102.619 177.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.44 ' HB3' HG21 ' A' ' 117' ' ' ILE . 79.9 t80 -134.4 156.05 49.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.736 0.779 . . . . 44.880000000000003 112.61 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.517 ' ND2' ' O ' ' A' ' 111' ' ' SER . 4.0 t-20 -123.06 132.18 24.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 107.726 -1.213 . . . . 51.770000000000003 107.726 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' PRO . . . . . 0.548 ' HG3' ' HE3' ' A' ' 108' ' ' MET . 97.2 Cg_exo -43.62 -31.44 3.27 Favored 'Trans proline' 0 C--N 1.329 -0.466 0 C-N-CA 122.315 2.01 . . . . 51.079999999999998 114.942 -179.688 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 109' ' ' SER . 0.4 OUTLIER -84.19 25.65 0.82 Allowed 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 112.484 0.55 . . . . 69.239999999999995 112.484 -178.867 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 86.42 -32.44 3.89 Favored Glycine 0 C--O 1.225 -0.454 0 N-CA-C 119.243 2.457 . . . . 56.5 119.243 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -62.06 150.92 36.9 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 118.861 1.331 . . . . 66.5 112.302 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.458 ' HA ' ' HE2' ' A' ' 114' ' ' PHE . . . -148.76 137.14 21.12 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 115.197 1.554 . . . . 51.600000000000001 115.197 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.4 mt -117.52 170.54 8.66 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.705 1.372 . . . . 45.0 114.705 -179.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -130.91 114.8 15.71 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.587 -1.264 . . . . 45.770000000000003 107.587 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLU . . . . . 0.531 ' O ' ' C ' ' A' ' 165' ' ' SER . 2.2 mt-10 -130.97 150.48 52.1 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 112.191 0.441 . . . . 60.530000000000001 112.191 -179.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' SER . . . . . 0.531 ' C ' ' O ' ' A' ' 164' ' ' GLU . 0.3 OUTLIER -29.56 125.06 0.14 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.461 -0.496 . . . . 51.119999999999997 112.131 -179.592 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' CYS . . . . . . . . . . . . . 50.5 m -57.66 -4.94 0.31 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.88 -0.415 . . . . 50.950000000000003 109.88 178.472 -76.462 -70.982 104.297 102.323 2.026 102.673 60.766 -85.056 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' GLU . . . . . 0.527 ' HA ' ' CG2' ' A' ' 81' ' ' THR . 2.2 mm-40 -106.9 11.76 29.6 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 113.485 0.921 . . . . 55.659999999999997 113.485 -179.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.74 -171.18 2.12 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.415 -0.957 . . . . 55.280000000000001 108.415 177.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' LYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 80' ' ' LYS . 14.5 mttt -132.02 81.21 1.95 Allowed 'General case' 0 C--O 1.244 0.779 0 N-CA-C 114.769 1.396 . . . . 55.049999999999997 114.769 -179.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -103.68 177.86 4.72 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.193 -0.912 . . . . 51.060000000000002 109.034 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ARG . . . . . 0.471 ' NH1' HE22 ' A' ' 113' ' ' GLN . 7.6 mtt180 -86.93 164.5 16.52 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.356 -0.609 . . . . 64.159999999999997 109.356 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -122.32 167.26 13.48 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 118.471 -1.292 . . . . 34.170000000000002 114.187 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ILE . . . . . 0.618 HG12 HG23 ' A' ' 75' ' ' ILE . 80.6 mt -140.32 113.28 5.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.15 -0.932 . . . . 26.969999999999999 110.593 179.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' CYS . . . . . 0.452 ' HB3' ' OG ' ' A' ' 94' ' ' SER . 3.6 m -100.83 163.1 12.47 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 105.748 -1.945 . . . . 28.07 105.748 178.563 -38.458 -66.587 -71.956 101.837 2.027 102.951 -54.332 -68.514 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 72' ' ' CYS . 0.1 OUTLIER -153.77 120.06 5.46 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 119.691 -0.804 . . . . 32.240000000000002 112.548 179.578 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -85.87 128.52 34.84 Favored 'General case' 0 C--O 1.24 0.569 0 N-CA-C 103.434 -2.802 . . . . 54.479999999999997 103.434 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -109.03 -34.21 6.68 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 120.335 3.457 . . . . 63.939999999999998 120.335 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 14.1 mt -138.99 131.34 28.43 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.705 -0.622 . . . . 72.010000000000005 111.238 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.34 0 CA-C-O 118.509 -0.758 . . . . 75.969999999999999 112.66 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HOH . . . . . 0.438 ' O ' ' HB3' ' A' ' 69' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . 0.475 ' O ' ' NE2' ' A' ' 98' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . 0.538 ' O ' ' HB ' ' A' ' 102' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . 0.601 ' O ' ' HE2' ' A' ' 150' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . 0.661 ' O ' ' HA ' ' A' ' 81' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . 0.447 ' O ' ' HB2' ' A' ' 131' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_