data_3h0i_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 3h0i _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 ' 84' ' ' VAL . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.51 2.554 0 N-CA-C 114.1 1.148 . . . . 31.48 114.1 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.8 m -80.95 126.74 31.76 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.426 -1.694 . . . . 24.97 106.426 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.2 mt -86.24 155.12 20.83 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.525 -0.735 . . . . 18.52 109.895 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -117.12 152.62 34.34 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.642 0.979 . . . . 14.43 113.642 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -125.23 139.75 50.26 Favored 'Isoleucine or valine' 0 C--O 1.259 1.599 0 CA-C-N 115.986 -0.552 . . . . 9.82 109.985 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.46 121.17 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 125.921 2.013 . . . . 9.16 109.2 -177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.1 mt -75.62 -28.74 58.97 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 114.449 -1.25 . . . . 15.6 111.909 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -141.74 165.79 26.5 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.476 -1.305 . . . . 17.79 107.476 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -68.24 148.56 50.65 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.705 1.253 . . . . 16.41 110.808 163.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -140.28 124.38 17.59 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 121.884 0.849 . . . . 13.93 109.939 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -102.15 133.15 47.47 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 106.138 -1.801 . . . . 28.8 106.138 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.67 136.56 57.7 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 109.142 -0.688 . . . . 13.69 109.142 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.9 mt -95.77 -55.65 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 O-C-N 125.45 1.719 . . . . 18.21 107.284 175.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 157.79 15.74 Favored 'General case' 0 CA--C 1.558 1.259 0 CA-C-O 122.399 1.095 . . . . 23.24 110.13 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -62.87 -13.82 38.68 Favored 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.6 -0.687 . . . . 49.48 112.321 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -97.58 -1.6 43.5 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.946 1.461 . . . . 26.13 114.946 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -80.28 157.03 26.54 Favored 'General case' 0 CA--C 1.469 -2.165 0 N-CA-C 108.501 -0.926 . . . . 18.88 108.501 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.7 tp -93.08 125.21 37.56 Favored 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.174 1.546 . . . . 15.68 108.987 165.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.5 m -79.41 152.48 30.32 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.717 -0.614 . . . . 17.21 112.451 163.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -164.9 164.63 20.78 Favored 'General case' 0 C--O 1.249 1.044 0 N-CA-C 112.659 0.614 . . . . 11.04 112.659 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -107.59 147.91 29.98 Favored 'General case' 0 N--CA 1.415 -2.201 0 O-C-N 124.584 1.177 . . . . 23.63 109.952 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.6 ttpt -45.44 139.13 3.87 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.178 -0.465 . . . . 29.35 110.966 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.71 -19.43 20.34 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-O 119.268 -0.74 . . . . 14.22 113.036 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -54.14 144.27 20.22 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.483 0.642 . . . . 14.05 112.221 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -107.38 152.38 24.25 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.971 0.73 . . . . 28.2 112.971 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -142.19 141.7 32.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.591 -1.186 . . . . 12.8 110.577 -171.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -85.52 132.52 34.18 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.606 -1.634 . . . . 20.93 108.791 152.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 45.1 mm -92.19 123.5 44.32 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 C-N-CA 119.813 -0.755 . . . . 13.81 109.371 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.4 mt -94.35 -43.51 8.36 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.24 1.016 . . . . 19.83 109.947 -170.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -142.77 138.92 30.79 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 123.485 1.612 . . . . 33.31 114.079 170.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 60.6 p -148.02 99.18 3.04 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-N 114.391 -1.277 . . . . 34.22 108.558 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 88.4 p -100.17 -176.92 3.37 Favored 'General case' 0 C--O 1.267 1.987 0 O-C-N 124.836 1.335 . . . . 36.41 108.858 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -55.63 3.29 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 CA-C-N 114.096 -1.411 . . . . 45.98 113.786 162.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -43.08 147.17 0.82 Allowed Glycine 0 N--CA 1.478 1.474 0 N-CA-C 119.12 2.408 . . . . 34.14 119.12 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.85 -20.03 64.27 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 118.588 -1.245 . . . . 28.93 108.434 153.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -115.04 134.04 55.52 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 123.726 0.81 . . . . 27.75 113.149 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -113.84 161.22 17.85 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.268 -1.382 . . . . 17.67 107.268 170.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -104.31 134.71 47.07 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 109.975 -0.38 . . . . 18.97 109.975 169.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.67 167.72 21.49 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 107.529 -1.286 . . . . 9.3 107.529 -173.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 36.9 ttp85 -125.01 128.26 48.28 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 126.125 1.77 . . . . 21.23 108.625 172.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 19.5 t -77.37 136.55 38.44 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.277 -0.874 . . . . 11.57 112.318 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 10.9 mp -88.2 -14.99 37.17 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.871 -0.604 . . . . 16.91 110.235 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' A' ' 202' ' ' HOH 0.336 0.1 OUTLIER -85.39 -47.22 10.19 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 117.198 -1.801 . . . . 21.72 115.269 170.572 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.9 p -95.7 -15.76 22.44 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 114.066 1.136 . . . . 14.5 114.066 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 68.53 14.16 66.62 Favored Glycine 0 C--N 1.338 0.682 0 CA-C-O 119.426 -0.652 . . . . 11.35 113.527 -170.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -83.68 149.5 26.45 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 117.879 0.84 . . . . 29.32 112.038 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 35.2 m -118.72 139.93 50.75 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.946 0.898 . . . . 11.18 109.908 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.79 -178.4 42.75 Favored Glycine 0 CA--C 1.507 -0.42 0 N-CA-C 108.469 -1.852 . . . . 7.66 108.469 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -81.97 145.59 30.19 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 113.226 0.824 . . . . 27.13 113.226 -176.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 23.4 pt -133.84 159.06 73.91 Favored Pre-proline 0 N--CA 1.438 -1.029 0 N-CA-C 107.739 -1.208 . . . . 13.26 107.739 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -73.23 126.62 11.24 Favored 'Trans proline' 0 C--N 1.368 1.562 0 O-C-N 124.115 1.587 . . . . 12.76 108.119 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 88.0 p -63.56 -26.09 68.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 112.867 0.692 . . . . 17.08 112.867 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -80.85 -0.98 41.34 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 115.093 1.516 . . . . 20.44 115.093 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -90.79 -1.85 57.82 Favored 'General case' 0 C--O 1.259 1.588 0 C-N-CA 118.953 -1.099 . . . . 13.25 112.022 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.31 156.9 42.1 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-O 120.974 0.416 . . . . 12.06 112.111 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -135.85 147.2 60.12 Favored Pre-proline 0 CA--C 1.551 0.999 0 N-CA-C 107.089 -1.448 . . . . 13.83 107.089 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -65.28 138.79 57.22 Favored 'Trans proline' 0 C--O 1.265 1.842 0 N-CA-C 113.695 0.613 . . . . 19.42 113.695 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.2 t -85.73 129.32 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 106.987 -1.486 . . . . 24.1 106.987 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.271 4.4 p30 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 115.172 1.545 . . . . 41.78 115.172 158.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 106.106 -1.813 . . . . 20.28 106.106 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 34.4 m -69.67 123.19 20.72 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 124.229 0.956 . . . . 19.97 110.527 175.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.13 153.42 28.69 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.499 0.719 . . . . 13.38 110.396 170.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -117.76 154.47 31.68 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.691 0.758 . . . . 14.33 112.228 -179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.77 134.83 64.58 Favored 'Isoleucine or valine' 0 C--O 1.253 1.238 0 CA-C-N 115.069 -0.969 . . . . 9.34 108.694 -178.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.93 121.66 14.63 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 117.797 2.517 . . . . 9.42 117.797 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.93 -21.89 40.09 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 121.564 -0.71 . . . . 22.42 112.454 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -147.37 164.61 32.74 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.852 -0.425 . . . . 20.7 109.852 -173.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.28 149.65 42.55 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.749 -1.204 . . . . 15.35 107.749 173.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -143.93 126.07 15.52 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 117.507 -1.677 . . . . 12.56 110.612 175.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -94.88 124.45 38.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 N-CA-C 108.434 -0.95 . . . . 41.94 108.434 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -42.93 135.81 2.92 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 116.07 1.878 . . . . 15.53 116.07 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 1.3 mp -98.21 -42.7 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 106.825 -1.546 . . . . 21.63 106.825 176.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 5.2 p -110.28 163.26 13.82 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 108.519 -0.919 . . . . 17.09 108.519 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . 0.62 ' CG ' ' O ' ' B' ' 207' ' ' HOH . 1.1 mm-40 -63.47 -24.28 67.76 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.597 0.759 . . . . 41.58 112.063 179.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.04 -0.28 56.84 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.55 1.315 . . . . 20.59 114.55 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.85 152.46 22.45 Favored 'General case' 0 CA--C 1.495 -1.16 0 C-N-CA 124.037 0.935 . . . . 18.64 110.478 -176.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -88.57 142.85 27.35 Favored 'General case' 0 C--O 1.254 1.32 0 N-CA-C 109.01 -0.737 . . . . 16.22 109.01 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 53.8 m -95.42 141.12 29.35 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 102.194 -3.261 . . . . 17.17 102.194 163.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -149.94 169.93 20.02 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 121.366 0.603 . . . . 13.03 112.3 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -111.6 147.18 36.01 Favored 'General case' 0 CA--C 1.561 1.379 0 O-C-N 121.682 -0.636 . . . . 16.68 109.468 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -37.38 136.81 0.45 Allowed 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.775 -0.578 . . . . 13.14 110.407 166.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.51 -14.43 62.76 Favored Glycine 0 C--O 1.237 0.299 0 O-C-N 121.003 -1.06 . . . . 12.56 114.521 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -69.02 143.34 54.36 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 119.454 -0.899 . . . . 14.04 110.605 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -110.59 151.2 27.92 Favored 'General case' 0 C--O 1.26 1.638 0 CA-C-O 122.227 1.013 . . . . 40.22 110.564 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -143.38 145.68 32.86 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.229 -1.351 . . . . 12.96 110.756 -168.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -92.83 138.69 31.27 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.17 -1.048 . . . . 14.49 108.17 156.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 35.8 mm -93.17 130.54 42.07 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 N-CA-C 105.546 -2.02 . . . . 13.52 105.546 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.33 -32.9 10.94 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.488 -0.778 . . . . 18.68 109.397 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -148.78 124.56 10.53 Favored 'General case' 0 C--O 1.253 1.255 0 C-N-CA 126.186 1.794 . . . . 28.09 111.835 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 46.8 p -125.55 21.28 7.82 Favored 'General case' 0 C--O 1.262 1.732 0 CA-C-O 122.506 1.146 . . . . 28.62 112.923 -170.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' B' ' 280' ' ' HOH . 20.2 p -109.66 160.75 16.02 Favored 'General case' 0 C--O 1.271 2.234 0 CA-C-N 114.385 -1.279 . . . . 35.44 111.526 -171.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 83.49 1.93 1.0 Allowed 'General case' 0 CA--C 1.554 1.121 0 CA-C-N 111.622 -2.535 . . . . 50.02 112.012 172.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 135.1 -143.72 15.45 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 109.411 -1.476 . . . . 30.22 109.411 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -100.45 -0.44 38.05 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 125.261 1.213 . . . . 28.39 113.125 -159.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -100.24 99.37 10.03 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 122.074 0.94 . . . . 16.22 109.561 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -99.57 153.75 18.8 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 115.906 -0.588 . . . . 14.91 109.925 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.23 132.13 46.89 Favored 'General case' 0 CA--C 1.485 -1.533 0 C-N-CA 118.899 -1.12 . . . . 17.63 109.04 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.55 160.07 40.92 Favored 'General case' 0 CA--C 1.561 1.376 0 O-C-N 124.207 0.942 . . . . 11.91 112.816 -166.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ARG . . . . . 0.567 ' CD ' ' O ' ' B' ' 205' ' ' HOH . 61.1 ttp85 -126.11 129.2 48.61 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 107.812 -1.181 . . . . 22.92 107.812 173.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 11.5 t -73.8 134.37 43.37 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 114.535 -1.211 . . . . 13.87 111.396 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 7.4 mp -79.54 -24.72 41.99 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.394 -0.595 . . . . 22.05 109.394 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' THR . . . . . . . . . . . . 0.262 24.2 m -64.85 -58.3 6.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 107.817 -1.179 . . . . 21.95 107.817 179.806 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 43.6 p -105.37 -10.25 17.09 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 118.434 2.754 . . . . 19.28 118.434 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 73.21 -3.35 31.15 Favored Glycine 0 C--O 1.209 -1.463 0 O-C-N 121.371 -0.831 . . . . 16.17 111.324 -174.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -68.5 138.07 54.9 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 120.981 -1.305 . . . . 37.13 112.654 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . 0.321 0.1 OUTLIER -110.72 143.73 40.75 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.229 1.937 . . . . 20.14 116.229 178.966 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.49 -174.42 45.04 Favored Glycine 0 C--O 1.204 -1.742 0 C-N-CA 119.495 -1.336 . . . . 11.24 113.742 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -87.73 145.98 25.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.377 0.608 . . . . 33.72 110.643 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 26.4 pt -139.41 145.4 43.92 Favored Pre-proline 0 N--CA 1.423 -1.798 0 CA-C-N 113.126 -1.852 . . . . 10.89 107.695 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.82 127.46 10.15 Favored 'Trans proline' 0 C--O 1.299 3.57 0 N-CA-C 107.84 -1.638 . . . . 12.64 107.84 175.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 92.0 p -61.94 -27.58 68.93 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 113.275 -1.784 . . . . 15.75 113.456 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -79.34 -2.52 41.94 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 121.472 0.653 . . . . 13.87 110.723 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -96.02 -0.74 50.12 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 114.539 1.311 . . . . 16.48 114.539 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 6.5 m -133.85 159.19 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.917 0 CA-C-N 118.672 0.669 . . . . 9.56 109.534 -176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.77 150.32 56.38 Favored Pre-proline 0 C--O 1.241 0.654 0 N-CA-C 108.56 -0.904 . . . . 13.85 108.56 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -69.78 141.78 46.06 Favored 'Trans proline' 0 C--N 1.352 0.723 0 O-C-N 122.817 0.903 . . . . 13.45 112.695 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 45.3 t -91.5 128.16 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 N-CA-C 106.31 -1.737 . . . . 21.32 106.31 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ASP . . . . . 0.46 ' OD1' ' O ' ' B' ' 142' ' ' ASP . 14.1 p30 . . . . . 0 CA--C 1.584 2.278 0 N-CA-C 117.717 2.488 . . . . 42.69 117.717 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.521 ' O ' ' CG2' ' A' ' 126' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . 0.567 ' O ' ' CD ' ' B' ' 123' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . 0.62 ' O ' ' CG ' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 261' ' ' HOH . . . . . 0.509 ' O ' ' CG ' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 280' ' ' HOH . . . . . 0.467 ' O ' ' CB ' ' B' ' 115' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.51 2.554 0 N-CA-C 114.1 1.148 . . . . 31.48 114.1 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.8 m -80.95 126.74 31.76 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.426 -1.694 . . . . 24.969999999999999 106.426 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.2 mt -86.24 155.12 20.83 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.525 -0.735 . . . . 18.52 109.895 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -117.12 152.62 34.34 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.642 0.979 . . . . 14.43 113.642 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -125.23 139.75 50.26 Favored 'Isoleucine or valine' 0 C--O 1.259 1.599 0 CA-C-N 115.986 -0.552 . . . . 9.8200000000000003 109.985 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . 0.488 ' HB2' ' HE2' ' A' ' 109' ' ' PHE . . . -76.46 121.17 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 125.921 2.013 . . . . 9.1600000000000001 109.2 -177.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.1 mt -75.62 -28.74 58.97 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 114.449 -1.25 . . . . 15.6 111.909 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -141.74 165.79 26.5 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.476 -1.305 . . . . 17.789999999999999 107.476 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -68.24 148.56 50.65 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.705 1.253 . . . . 16.41 110.808 163.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -140.28 124.38 17.59 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 121.884 0.849 . . . . 13.93 109.939 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -102.15 133.15 47.47 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 106.138 -1.801 . . . . 28.800000000000001 106.138 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.67 136.56 57.7 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 109.142 -0.688 . . . . 13.69 109.142 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.9 mt -95.77 -55.65 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 O-C-N 125.45 1.719 . . . . 18.210000000000001 107.284 175.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 157.79 15.74 Favored 'General case' 0 CA--C 1.558 1.259 0 CA-C-O 122.399 1.095 . . . . 23.239999999999998 110.13 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -62.87 -13.82 38.68 Favored 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.6 -0.687 . . . . 49.479999999999997 112.321 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -97.58 -1.6 43.5 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.946 1.461 . . . . 26.129999999999999 114.946 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -80.28 157.03 26.54 Favored 'General case' 0 CA--C 1.469 -2.165 0 N-CA-C 108.501 -0.926 . . . . 18.879999999999999 108.501 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.7 tp -93.08 125.21 37.56 Favored 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.174 1.546 . . . . 15.68 108.987 165.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.5 m -79.41 152.48 30.32 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.717 -0.614 . . . . 17.210000000000001 112.451 163.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PHE . . . . . 0.464 ' CG ' ' HZ ' ' A' ' 109' ' ' PHE . 36.2 p90 -164.9 164.63 20.78 Favored 'General case' 0 C--O 1.249 1.044 0 N-CA-C 112.659 0.614 . . . . 11.039999999999999 112.659 -178.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -107.59 147.91 29.98 Favored 'General case' 0 N--CA 1.415 -2.201 0 O-C-N 124.584 1.177 . . . . 23.629999999999999 109.952 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.6 ttpt -45.44 139.13 3.87 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.178 -0.465 . . . . 29.350000000000001 110.966 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.71 -19.43 20.34 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-O 119.268 -0.74 . . . . 14.220000000000001 113.036 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . 0.713 ' HG3' HG23 ' A' ' 126' ' ' THR . 27.8 tt0 -54.14 144.27 20.22 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.483 0.642 . . . . 14.050000000000001 112.221 176.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -107.38 152.38 24.25 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.971 0.73 . . . . 28.199999999999999 112.971 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PHE . . . . . 0.488 ' HE2' ' HB2' ' A' ' 89' ' ' ALA . 67.2 m-85 -142.19 141.7 32.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.591 -1.186 . . . . 12.800000000000001 110.577 -171.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -85.52 132.52 34.18 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.606 -1.634 . . . . 20.93 108.791 152.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 45.1 mm -92.19 123.5 44.32 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 C-N-CA 119.813 -0.755 . . . . 13.81 109.371 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.4 mt -94.35 -43.51 8.36 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.24 1.016 . . . . 19.829999999999998 109.947 -170.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -142.77 138.92 30.79 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 123.485 1.612 . . . . 33.310000000000002 114.079 170.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 60.6 p -148.02 99.18 3.04 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-N 114.391 -1.277 . . . . 34.219999999999999 108.558 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 88.4 p -100.17 -176.92 3.37 Favored 'General case' 0 C--O 1.267 1.987 0 O-C-N 124.836 1.335 . . . . 36.409999999999997 108.858 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -55.63 3.29 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 CA-C-N 114.096 -1.411 . . . . 45.979999999999997 113.786 162.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -43.08 147.17 0.82 Allowed Glycine 0 N--CA 1.478 1.474 0 N-CA-C 119.12 2.408 . . . . 34.140000000000001 119.12 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.85 -20.03 64.27 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 118.588 -1.245 . . . . 28.93 108.434 153.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -115.04 134.04 55.52 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 123.726 0.81 . . . . 27.75 113.149 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -113.84 161.22 17.85 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.268 -1.382 . . . . 17.670000000000002 107.268 170.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -104.31 134.71 47.07 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 109.975 -0.38 . . . . 18.969999999999999 109.975 169.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.67 167.72 21.49 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 107.529 -1.286 . . . . 9.3000000000000007 107.529 -173.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 36.9 ttp85 -125.01 128.26 48.28 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 126.125 1.77 . . . . 21.23 108.625 172.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 19.5 t -77.37 136.55 38.44 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.277 -0.874 . . . . 11.57 112.318 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 10.9 mp -88.2 -14.99 37.17 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.871 -0.604 . . . . 16.91 110.235 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . 0.828 HG22 ' O ' ' A' ' 202' ' ' HOH 0.336 0.1 OUTLIER -85.39 -47.22 10.19 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 117.198 -1.801 . . . . 21.719999999999999 115.269 170.572 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.9 p -95.7 -15.76 22.44 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 114.066 1.136 . . . . 14.5 114.066 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 68.53 14.16 66.62 Favored Glycine 0 C--N 1.338 0.682 0 CA-C-O 119.426 -0.652 . . . . 11.35 113.527 -170.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -83.68 149.5 26.45 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 117.879 0.84 . . . . 29.32 112.038 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 35.2 m -118.72 139.93 50.75 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.946 0.898 . . . . 11.18 109.908 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.79 -178.4 42.75 Favored Glycine 0 CA--C 1.507 -0.42 0 N-CA-C 108.469 -1.852 . . . . 7.6600000000000001 108.469 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -81.97 145.59 30.19 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 113.226 0.824 . . . . 27.129999999999999 113.226 -176.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 23.4 pt -133.84 159.06 73.91 Favored Pre-proline 0 N--CA 1.438 -1.029 0 N-CA-C 107.739 -1.208 . . . . 13.26 107.739 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -73.23 126.62 11.24 Favored 'Trans proline' 0 C--N 1.368 1.562 0 O-C-N 124.115 1.587 . . . . 12.76 108.119 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 88.0 p -63.56 -26.09 68.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 112.867 0.692 . . . . 17.079999999999998 112.867 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -80.85 -0.98 41.34 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 115.093 1.516 . . . . 20.440000000000001 115.093 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -90.79 -1.85 57.82 Favored 'General case' 0 C--O 1.259 1.588 0 C-N-CA 118.953 -1.099 . . . . 13.25 112.022 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.31 156.9 42.1 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-O 120.974 0.416 . . . . 12.06 112.111 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -135.85 147.2 60.12 Favored Pre-proline 0 CA--C 1.551 0.999 0 N-CA-C 107.089 -1.448 . . . . 13.83 107.089 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -65.28 138.79 57.22 Favored 'Trans proline' 0 C--O 1.265 1.842 0 N-CA-C 113.695 0.613 . . . . 19.420000000000002 113.695 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.2 t -85.73 129.32 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 106.987 -1.486 . . . . 24.100000000000001 106.987 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.271 4.4 p30 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 115.172 1.545 . . . . 41.780000000000001 115.172 158.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 106.106 -1.813 . . . . 20.280000000000001 106.106 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 34.4 m -69.67 123.19 20.72 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 124.229 0.956 . . . . 19.969999999999999 110.527 175.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.13 153.42 28.69 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.499 0.719 . . . . 13.380000000000001 110.396 170.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . 0.4 ' O ' ' HA ' ' B' ' 108' ' ' LYS . 10.1 m-85 -117.76 154.47 31.68 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.691 0.758 . . . . 14.33 112.228 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.77 134.83 64.58 Favored 'Isoleucine or valine' 0 C--O 1.253 1.238 0 CA-C-N 115.069 -0.969 . . . . 9.3399999999999999 108.694 -178.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.93 121.66 14.63 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 117.797 2.517 . . . . 9.4199999999999999 117.797 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.93 -21.89 40.09 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 121.564 -0.71 . . . . 22.420000000000002 112.454 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -147.37 164.61 32.74 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.852 -0.425 . . . . 20.699999999999999 109.852 -173.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.28 149.65 42.55 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.749 -1.204 . . . . 15.35 107.749 173.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TYR . . . . . 0.572 ' OH ' HD12 ' B' ' 96' ' ' ILE . 75.1 t80 -143.93 126.07 15.52 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 117.507 -1.677 . . . . 12.56 110.612 175.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -94.88 124.45 38.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 N-CA-C 108.434 -0.95 . . . . 41.939999999999998 108.434 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -42.93 135.81 2.92 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 116.07 1.878 . . . . 15.529999999999999 116.07 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ILE . . . . . 0.572 HD12 ' OH ' ' B' ' 93' ' ' TYR . 1.3 mp -98.21 -42.7 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 106.825 -1.546 . . . . 21.629999999999999 106.825 176.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 5.2 p -110.28 163.26 13.82 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 108.519 -0.919 . . . . 17.09 108.519 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . 0.978 ' HG2' ' O ' ' B' ' 207' ' ' HOH . 1.1 mm-40 -63.47 -24.28 67.76 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.597 0.759 . . . . 41.579999999999998 112.063 179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.04 -0.28 56.84 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.55 1.315 . . . . 20.59 114.55 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.85 152.46 22.45 Favored 'General case' 0 CA--C 1.495 -1.16 0 C-N-CA 124.037 0.935 . . . . 18.640000000000001 110.478 -176.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -88.57 142.85 27.35 Favored 'General case' 0 C--O 1.254 1.32 0 N-CA-C 109.01 -0.737 . . . . 16.219999999999999 109.01 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 53.8 m -95.42 141.12 29.35 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 102.194 -3.261 . . . . 17.170000000000002 102.194 163.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -149.94 169.93 20.02 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 121.366 0.603 . . . . 13.029999999999999 112.3 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -111.6 147.18 36.01 Favored 'General case' 0 CA--C 1.561 1.379 0 O-C-N 121.682 -0.636 . . . . 16.68 109.468 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -37.38 136.81 0.45 Allowed 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.775 -0.578 . . . . 13.140000000000001 110.407 166.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.51 -14.43 62.76 Favored Glycine 0 C--O 1.237 0.299 0 O-C-N 121.003 -1.06 . . . . 12.56 114.521 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -69.02 143.34 54.36 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 119.454 -0.899 . . . . 14.039999999999999 110.605 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 87' ' ' PHE . 58.8 mtpt -110.59 151.2 27.92 Favored 'General case' 0 C--O 1.26 1.638 0 CA-C-O 122.227 1.013 . . . . 40.219999999999999 110.564 -177.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -143.38 145.68 32.86 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.229 -1.351 . . . . 12.960000000000001 110.756 -168.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -92.83 138.69 31.27 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.17 -1.048 . . . . 14.49 108.17 156.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 35.8 mm -93.17 130.54 42.07 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 N-CA-C 105.546 -2.02 . . . . 13.52 105.546 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.33 -32.9 10.94 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.488 -0.778 . . . . 18.68 109.397 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -148.78 124.56 10.53 Favored 'General case' 0 C--O 1.253 1.255 0 C-N-CA 126.186 1.794 . . . . 28.09 111.835 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 46.8 p -125.55 21.28 7.82 Favored 'General case' 0 C--O 1.262 1.732 0 CA-C-O 122.506 1.146 . . . . 28.620000000000001 112.923 -170.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . 0.795 ' HB3' ' O ' ' B' ' 280' ' ' HOH . 20.2 p -109.66 160.75 16.02 Favored 'General case' 0 C--O 1.271 2.234 0 CA-C-N 114.385 -1.279 . . . . 35.439999999999998 111.526 -171.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 115' ' ' SER . 45.2 mt-10 83.49 1.93 1.0 Allowed 'General case' 0 CA--C 1.554 1.121 0 CA-C-N 111.622 -2.535 . . . . 50.020000000000003 112.012 172.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 135.1 -143.72 15.45 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 109.411 -1.476 . . . . 30.219999999999999 109.411 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -100.45 -0.44 38.05 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 125.261 1.213 . . . . 28.390000000000001 113.125 -159.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -100.24 99.37 10.03 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 122.074 0.94 . . . . 16.219999999999999 109.561 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -99.57 153.75 18.8 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 115.906 -0.588 . . . . 14.91 109.925 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.23 132.13 46.89 Favored 'General case' 0 CA--C 1.485 -1.533 0 C-N-CA 118.899 -1.12 . . . . 17.629999999999999 109.04 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.55 160.07 40.92 Favored 'General case' 0 CA--C 1.561 1.376 0 O-C-N 124.207 0.942 . . . . 11.91 112.816 -166.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ARG . . . . . 1.053 ' HD2' ' O ' ' B' ' 205' ' ' HOH . 61.1 ttp85 -126.11 129.2 48.61 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 107.812 -1.181 . . . . 22.920000000000002 107.812 173.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 11.5 t -73.8 134.37 43.37 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 114.535 -1.211 . . . . 13.869999999999999 111.396 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 7.4 mp -79.54 -24.72 41.99 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.394 -0.595 . . . . 22.050000000000001 109.394 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' THR . . . . . . . . . . . . 0.262 24.2 m -64.85 -58.3 6.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 107.817 -1.179 . . . . 21.949999999999999 107.817 179.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 43.6 p -105.37 -10.25 17.09 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 118.434 2.754 . . . . 19.280000000000001 118.434 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 73.21 -3.35 31.15 Favored Glycine 0 C--O 1.209 -1.463 0 O-C-N 121.371 -0.831 . . . . 16.170000000000002 111.324 -174.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -68.5 138.07 54.9 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 120.981 -1.305 . . . . 37.130000000000003 112.654 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . 0.321 0.1 OUTLIER -110.72 143.73 40.75 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.229 1.937 . . . . 20.140000000000001 116.229 178.966 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.49 -174.42 45.04 Favored Glycine 0 C--O 1.204 -1.742 0 C-N-CA 119.495 -1.336 . . . . 11.24 113.742 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -87.73 145.98 25.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.377 0.608 . . . . 33.719999999999999 110.643 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 26.4 pt -139.41 145.4 43.92 Favored Pre-proline 0 N--CA 1.423 -1.798 0 CA-C-N 113.126 -1.852 . . . . 10.890000000000001 107.695 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.82 127.46 10.15 Favored 'Trans proline' 0 C--O 1.299 3.57 0 N-CA-C 107.84 -1.638 . . . . 12.640000000000001 107.84 175.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 92.0 p -61.94 -27.58 68.93 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 113.275 -1.784 . . . . 15.75 113.456 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -79.34 -2.52 41.94 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 121.472 0.653 . . . . 13.869999999999999 110.723 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -96.02 -0.74 50.12 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 114.539 1.311 . . . . 16.48 114.539 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 6.5 m -133.85 159.19 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.917 0 CA-C-N 118.672 0.669 . . . . 9.5600000000000005 109.534 -176.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.77 150.32 56.38 Favored Pre-proline 0 C--O 1.241 0.654 0 N-CA-C 108.56 -0.904 . . . . 13.85 108.56 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -69.78 141.78 46.06 Favored 'Trans proline' 0 C--N 1.352 0.723 0 O-C-N 122.817 0.903 . . . . 13.449999999999999 112.695 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 45.3 t -91.5 128.16 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 N-CA-C 106.31 -1.737 . . . . 21.32 106.31 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ASP . . . . . 0.46 ' O ' ' OD1' ' B' ' 142' ' ' ASP . 14.1 p30 . . . . . 0 CA--C 1.584 2.278 0 N-CA-C 117.717 2.488 . . . . 42.689999999999998 117.717 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.828 ' O ' HG22 ' A' ' 126' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . 0.488 ' O ' HG21 ' A' ' 126' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . 1.053 ' O ' ' HD2' ' B' ' 123' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . 0.978 ' O ' ' HG2' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 261' ' ' HOH . . . . . 0.943 ' O ' ' HG3' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 280' ' ' HOH . . . . . 0.795 ' O ' ' HB3' ' B' ' 115' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.51 2.554 0 N-CA-C 114.1 1.148 . . . . 31.48 114.1 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.8 m -80.95 126.74 31.76 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.426 -1.694 . . . . 24.969999999999999 106.426 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.2 mt -86.24 155.12 20.83 Favored 'General case' 0 C--N 1.313 -1.017 0 O-C-N 121.525 -0.735 . . . . 18.52 109.895 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -117.12 152.62 34.34 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 113.642 0.979 . . . . 14.43 113.642 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 9.9 p -125.23 139.75 50.26 Favored 'Isoleucine or valine' 0 C--O 1.259 1.599 0 CA-C-N 115.986 -0.552 . . . . 9.8200000000000003 109.985 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.488 ' HB2' ' HE2' ' A' ' 109' ' ' PHE . . . -76.46 121.17 22.7 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 125.921 2.013 . . . . 9.1600000000000001 109.2 -177.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.1 mt -75.62 -28.74 58.97 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 114.449 -1.25 . . . . 15.6 111.909 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -141.74 165.79 26.5 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.476 -1.305 . . . . 17.789999999999999 107.476 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -68.24 148.56 50.65 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 124.705 1.253 . . . . 16.41 110.808 163.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -140.28 124.38 17.59 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-O 121.884 0.849 . . . . 13.93 109.939 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -102.15 133.15 47.47 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 106.138 -1.801 . . . . 28.800000000000001 106.138 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -58.67 136.56 57.7 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 109.142 -0.688 . . . . 13.69 109.142 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 75.9 mt -95.77 -55.65 5.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 O-C-N 125.45 1.719 . . . . 18.210000000000001 107.284 175.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 157.79 15.74 Favored 'General case' 0 CA--C 1.558 1.259 0 CA-C-O 122.399 1.095 . . . . 23.239999999999998 110.13 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -62.87 -13.82 38.68 Favored 'General case' 0 CA--C 1.553 1.089 0 O-C-N 121.6 -0.687 . . . . 49.479999999999997 112.321 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -97.58 -1.6 43.5 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 114.946 1.461 . . . . 26.129999999999999 114.946 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -80.28 157.03 26.54 Favored 'General case' 0 CA--C 1.469 -2.165 0 N-CA-C 108.501 -0.926 . . . . 18.879999999999999 108.501 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.7 tp -93.08 125.21 37.56 Favored 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.174 1.546 . . . . 15.68 108.987 165.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.5 m -79.41 152.48 30.32 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.717 -0.614 . . . . 17.210000000000001 112.451 163.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.464 ' CG ' ' HZ ' ' A' ' 109' ' ' PHE . 36.2 p90 -164.9 164.63 20.78 Favored 'General case' 0 C--O 1.249 1.044 0 N-CA-C 112.659 0.614 . . . . 11.039999999999999 112.659 -178.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -107.59 147.91 29.98 Favored 'General case' 0 N--CA 1.415 -2.201 0 O-C-N 124.584 1.177 . . . . 23.629999999999999 109.952 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 22.6 ttpt -45.44 139.13 3.87 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.178 -0.465 . . . . 29.350000000000001 110.966 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.71 -19.43 20.34 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-O 119.268 -0.74 . . . . 14.220000000000001 113.036 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.713 ' HG3' HG23 ' A' ' 126' ' ' THR . 27.8 tt0 -54.14 144.27 20.22 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.483 0.642 . . . . 14.050000000000001 112.221 176.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -107.38 152.38 24.25 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.971 0.73 . . . . 28.199999999999999 112.971 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.488 ' HE2' ' HB2' ' A' ' 89' ' ' ALA . 67.2 m-85 -142.19 141.7 32.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.591 -1.186 . . . . 12.800000000000001 110.577 -171.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -85.52 132.52 34.18 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.606 -1.634 . . . . 20.93 108.791 152.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 45.1 mm -92.19 123.5 44.32 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.789 0 C-N-CA 119.813 -0.755 . . . . 13.81 109.371 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 97.4 mt -94.35 -43.51 8.36 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.24 1.016 . . . . 19.829999999999998 109.947 -170.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -142.77 138.92 30.79 Favored 'General case' 0 N--CA 1.428 -1.534 0 CA-C-O 123.485 1.612 . . . . 33.310000000000002 114.079 170.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 60.6 p -148.02 99.18 3.04 Favored 'General case' 0 C--O 1.25 1.112 0 CA-C-N 114.391 -1.277 . . . . 34.219999999999999 108.558 -173.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 88.4 p -100.17 -176.92 3.37 Favored 'General case' 0 C--O 1.267 1.987 0 O-C-N 124.836 1.335 . . . . 36.409999999999997 108.858 174.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -55.63 3.29 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 CA-C-N 114.096 -1.411 . . . . 45.979999999999997 113.786 162.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -43.08 147.17 0.82 Allowed Glycine 0 N--CA 1.478 1.474 0 N-CA-C 119.12 2.408 . . . . 34.140000000000001 119.12 165.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -68.85 -20.03 64.27 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 118.588 -1.245 . . . . 28.93 108.434 153.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -115.04 134.04 55.52 Favored 'General case' 0 CA--C 1.513 -0.445 0 C-N-CA 123.726 0.81 . . . . 27.75 113.149 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -113.84 161.22 17.85 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 107.268 -1.382 . . . . 17.670000000000002 107.268 170.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -104.31 134.71 47.07 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 109.975 -0.38 . . . . 18.969999999999999 109.975 169.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.67 167.72 21.49 Favored 'General case' 0 CA--C 1.489 -1.392 0 N-CA-C 107.529 -1.286 . . . . 9.3000000000000007 107.529 -173.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 36.9 ttp85 -125.01 128.26 48.28 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 126.125 1.77 . . . . 21.23 108.625 172.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 19.5 t -77.37 136.55 38.44 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 115.277 -0.874 . . . . 11.57 112.318 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 10.9 mp -88.2 -14.99 37.17 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.871 -0.604 . . . . 16.91 110.235 -179.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . 0.828 HG22 ' O ' ' A' ' 202' ' ' HOH 0.336 0.1 OUTLIER -85.39 -47.22 10.19 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 117.198 -1.801 . . . . 21.719999999999999 115.269 170.572 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 62.9 p -95.7 -15.76 22.44 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 114.066 1.136 . . . . 14.5 114.066 177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 68.53 14.16 66.62 Favored Glycine 0 C--N 1.338 0.682 0 CA-C-O 119.426 -0.652 . . . . 11.35 113.527 -170.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -83.68 149.5 26.45 Favored 'General case' 0 N--CA 1.489 1.493 0 CA-C-N 117.879 0.84 . . . . 29.32 112.038 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 35.2 m -118.72 139.93 50.75 Favored 'General case' 0 C--O 1.245 0.86 0 C-N-CA 123.946 0.898 . . . . 11.18 109.908 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 169.79 -178.4 42.75 Favored Glycine 0 CA--C 1.507 -0.42 0 N-CA-C 108.469 -1.852 . . . . 7.6600000000000001 108.469 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -81.97 145.59 30.19 Favored 'General case' 0 CA--C 1.497 -1.079 0 N-CA-C 113.226 0.824 . . . . 27.129999999999999 113.226 -176.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 23.4 pt -133.84 159.06 73.91 Favored Pre-proline 0 N--CA 1.438 -1.029 0 N-CA-C 107.739 -1.208 . . . . 13.26 107.739 179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -73.23 126.62 11.24 Favored 'Trans proline' 0 C--N 1.368 1.562 0 O-C-N 124.115 1.587 . . . . 12.76 108.119 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 88.0 p -63.56 -26.09 68.54 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 112.867 0.692 . . . . 17.079999999999998 112.867 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -80.85 -0.98 41.34 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 115.093 1.516 . . . . 20.440000000000001 115.093 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -90.79 -1.85 57.82 Favored 'General case' 0 C--O 1.259 1.588 0 C-N-CA 118.953 -1.099 . . . . 13.25 112.022 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 31.3 m -129.31 156.9 42.1 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-O 120.974 0.416 . . . . 12.06 112.111 -177.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -135.85 147.2 60.12 Favored Pre-proline 0 CA--C 1.551 0.999 0 N-CA-C 107.089 -1.448 . . . . 13.83 107.089 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -65.28 138.79 57.22 Favored 'Trans proline' 0 C--O 1.265 1.842 0 N-CA-C 113.695 0.613 . . . . 19.420000000000002 113.695 176.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 25.2 t -85.73 129.32 38.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 N-CA-C 106.987 -1.486 . . . . 24.100000000000001 106.987 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.271 4.4 p30 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 115.172 1.545 . . . . 41.780000000000001 115.172 158.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 17.3 m . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 106.106 -1.813 . . . . 20.280000000000001 106.106 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 34.4 m -69.67 123.19 20.72 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 124.229 0.956 . . . . 19.969999999999999 110.527 175.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.13 153.42 28.69 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.499 0.719 . . . . 13.380000000000001 110.396 170.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.4 ' O ' ' HA ' ' B' ' 108' ' ' LYS . 10.1 m-85 -117.76 154.47 31.68 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.691 0.758 . . . . 14.33 112.228 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 9.3 p -127.77 134.83 64.58 Favored 'Isoleucine or valine' 0 C--O 1.253 1.238 0 CA-C-N 115.069 -0.969 . . . . 9.3399999999999999 108.694 -178.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.93 121.66 14.63 Favored 'General case' 0 CA--C 1.561 1.392 0 N-CA-C 117.797 2.517 . . . . 9.4199999999999999 117.797 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.93 -21.89 40.09 Favored 'General case' 0 CA--C 1.501 -0.932 0 O-C-N 121.564 -0.71 . . . . 22.420000000000002 112.454 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -147.37 164.61 32.74 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 109.852 -0.425 . . . . 20.699999999999999 109.852 -173.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -73.28 149.65 42.55 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 107.749 -1.204 . . . . 15.35 107.749 173.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TYR . . . . . 0.572 ' OH ' HD12 ' B' ' 96' ' ' ILE . 75.1 t80 -143.93 126.07 15.52 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 117.507 -1.677 . . . . 12.56 110.612 175.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -94.88 124.45 38.93 Favored 'General case' 0 CA--C 1.493 -1.218 0 N-CA-C 108.434 -0.95 . . . . 41.939999999999998 108.434 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -42.93 135.81 2.92 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 116.07 1.878 . . . . 15.529999999999999 116.07 174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ILE . . . . . 0.572 HD12 ' OH ' ' B' ' 93' ' ' TYR . 1.3 mp -98.21 -42.7 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 N-CA-C 106.825 -1.546 . . . . 21.629999999999999 106.825 176.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 5.2 p -110.28 163.26 13.82 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 108.519 -0.919 . . . . 17.09 108.519 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.978 ' HG2' ' O ' ' B' ' 207' ' ' HOH . 1.1 mm-40 -63.47 -24.28 67.76 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.597 0.759 . . . . 41.579999999999998 112.063 179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -88.04 -0.28 56.84 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.55 1.315 . . . . 20.59 114.55 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.85 152.46 22.45 Favored 'General case' 0 CA--C 1.495 -1.16 0 C-N-CA 124.037 0.935 . . . . 18.640000000000001 110.478 -176.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 34.0 mt -88.57 142.85 27.35 Favored 'General case' 0 C--O 1.254 1.32 0 N-CA-C 109.01 -0.737 . . . . 16.219999999999999 109.01 165.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 53.8 m -95.42 141.12 29.35 Favored 'General case' 0 CA--C 1.507 -0.701 0 N-CA-C 102.194 -3.261 . . . . 17.170000000000002 102.194 163.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -149.94 169.93 20.02 Favored 'General case' 0 C--O 1.201 -1.474 0 CA-C-O 121.366 0.603 . . . . 13.029999999999999 112.3 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 23.0 p-80 -111.6 147.18 36.01 Favored 'General case' 0 CA--C 1.561 1.379 0 O-C-N 121.682 -0.636 . . . . 16.68 109.468 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -37.38 136.81 0.45 Allowed 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.775 -0.578 . . . . 13.140000000000001 110.407 166.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.51 -14.43 62.76 Favored Glycine 0 C--O 1.237 0.299 0 O-C-N 121.003 -1.06 . . . . 12.56 114.521 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -69.02 143.34 54.36 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 119.454 -0.899 . . . . 14.039999999999999 110.605 177.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 87' ' ' PHE . 58.8 mtpt -110.59 151.2 27.92 Favored 'General case' 0 C--O 1.26 1.638 0 CA-C-O 122.227 1.013 . . . . 40.219999999999999 110.564 -177.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -143.38 145.68 32.86 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.229 -1.351 . . . . 12.960000000000001 110.756 -168.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -92.83 138.69 31.27 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.17 -1.048 . . . . 14.49 108.17 156.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 35.8 mm -93.17 130.54 42.07 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 N-CA-C 105.546 -2.02 . . . . 13.52 105.546 175.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 24.4 mt -99.33 -32.9 10.94 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 115.488 -0.778 . . . . 18.68 109.397 -178.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 59.6 t-20 -148.78 124.56 10.53 Favored 'General case' 0 C--O 1.253 1.255 0 C-N-CA 126.186 1.794 . . . . 28.09 111.835 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 46.8 p -125.55 21.28 7.82 Favored 'General case' 0 C--O 1.262 1.732 0 CA-C-O 122.506 1.146 . . . . 28.620000000000001 112.923 -170.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . 0.795 ' HB3' ' O ' ' B' ' 280' ' ' HOH . 20.2 p -109.66 160.75 16.02 Favored 'General case' 0 C--O 1.271 2.234 0 CA-C-N 114.385 -1.279 . . . . 35.439999999999998 111.526 -171.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLU . . . . . 0.52 ' HB2' ' O ' ' B' ' 115' ' ' SER . 45.2 mt-10 83.49 1.93 1.0 Allowed 'General case' 0 CA--C 1.554 1.121 0 CA-C-N 111.622 -2.535 . . . . 50.020000000000003 112.012 172.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 135.1 -143.72 15.45 Favored Glycine 0 CA--C 1.497 -1.065 0 N-CA-C 109.411 -1.476 . . . . 30.219999999999999 109.411 174.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -100.45 -0.44 38.05 Favored 'General case' 0 C--O 1.215 -0.711 0 O-C-N 125.261 1.213 . . . . 28.390000000000001 113.125 -159.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -100.24 99.37 10.03 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 122.074 0.94 . . . . 16.219999999999999 109.561 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -99.57 153.75 18.8 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 115.906 -0.588 . . . . 14.91 109.925 -170.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -101.23 132.13 46.89 Favored 'General case' 0 CA--C 1.485 -1.533 0 C-N-CA 118.899 -1.12 . . . . 17.629999999999999 109.04 175.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.55 160.07 40.92 Favored 'General case' 0 CA--C 1.561 1.376 0 O-C-N 124.207 0.942 . . . . 11.91 112.816 -166.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ARG . . . . . 1.053 ' HD2' ' O ' ' B' ' 205' ' ' HOH . 61.1 ttp85 -126.11 129.2 48.61 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 107.812 -1.181 . . . . 22.920000000000002 107.812 173.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 11.5 t -73.8 134.37 43.37 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 114.535 -1.211 . . . . 13.869999999999999 111.396 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 7.4 mp -79.54 -24.72 41.99 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.394 -0.595 . . . . 22.050000000000001 109.394 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' THR . . . . . . . . . . . . 0.262 24.2 m -64.85 -58.3 6.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 107.817 -1.179 . . . . 21.949999999999999 107.817 179.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 43.6 p -105.37 -10.25 17.09 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 118.434 2.754 . . . . 19.280000000000001 118.434 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 73.21 -3.35 31.15 Favored Glycine 0 C--O 1.209 -1.463 0 O-C-N 121.371 -0.831 . . . . 16.170000000000002 111.324 -174.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -68.5 138.07 54.9 Favored 'General case' 0 CA--C 1.556 1.177 0 O-C-N 120.981 -1.305 . . . . 37.130000000000003 112.654 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . 0.321 0.1 OUTLIER -110.72 143.73 40.75 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.229 1.937 . . . . 20.140000000000001 116.229 178.966 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 171.49 -174.42 45.04 Favored Glycine 0 C--O 1.204 -1.742 0 C-N-CA 119.495 -1.336 . . . . 11.24 113.742 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -87.73 145.98 25.88 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 121.377 0.608 . . . . 33.719999999999999 110.643 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 26.4 pt -139.41 145.4 43.92 Favored Pre-proline 0 N--CA 1.423 -1.798 0 CA-C-N 113.126 -1.852 . . . . 10.890000000000001 107.695 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.82 127.46 10.15 Favored 'Trans proline' 0 C--O 1.299 3.57 0 N-CA-C 107.84 -1.638 . . . . 12.640000000000001 107.84 175.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 92.0 p -61.94 -27.58 68.93 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 113.275 -1.784 . . . . 15.75 113.456 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -79.34 -2.52 41.94 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-O 121.472 0.653 . . . . 13.869999999999999 110.723 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -96.02 -0.74 50.12 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 114.539 1.311 . . . . 16.48 114.539 176.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 6.5 m -133.85 159.19 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.917 0 CA-C-N 118.672 0.669 . . . . 9.5600000000000005 109.534 -176.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.77 150.32 56.38 Favored Pre-proline 0 C--O 1.241 0.654 0 N-CA-C 108.56 -0.904 . . . . 13.85 108.56 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -69.78 141.78 46.06 Favored 'Trans proline' 0 C--N 1.352 0.723 0 O-C-N 122.817 0.903 . . . . 13.449999999999999 112.695 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 45.3 t -91.5 128.16 43.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 N-CA-C 106.31 -1.737 . . . . 21.32 106.31 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ASP . . . . . 0.46 ' O ' ' OD1' ' B' ' 142' ' ' ASP . 14.1 p30 . . . . . 0 CA--C 1.584 2.278 0 N-CA-C 117.717 2.488 . . . . 42.689999999999998 117.717 -172.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.828 ' O ' HG22 ' A' ' 126' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . 0.488 ' O ' HG21 ' A' ' 126' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . 1.053 ' O ' ' HD2' ' B' ' 123' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . 0.978 ' O ' ' HG2' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 261' ' ' HOH . . . . . 0.943 ' O ' ' HG3' ' B' ' 98' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 280' ' ' HOH . . . . . 0.795 ' O ' ' HB3' ' B' ' 115' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_