data_1shf_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 1shf _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 . . . . . . . . . . . . . 81.9 t . . . . . 0 N--CA 1.445 -0.698 0 CA-C-O 122.394 1.092 . . . . 100.0 110.055 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.8 m -125.17 142.09 51.71 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 102.882 -3.007 . . . . 82.15 102.882 173.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 73.7 mt -78.59 158.11 28.56 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 114.991 -2.684 . . . . 46.43 107.738 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -123.16 157.04 33.85 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 106.642 -1.614 . . . . 27.74 106.642 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.8 139.97 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 120.312 1.414 . . . . 20.89 108.288 -177.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.56 132.29 47.28 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-O 117.705 -1.14 . . . . 20.71 111.718 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.3 mt -86.33 -26.27 24.97 Favored 'General case' 0 C--O 1.25 1.087 0 O-C-N 125.388 1.68 . . . . 24.77 114.183 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -145.03 164.14 32.09 Favored 'General case' 0 CA--C 1.483 -1.612 0 C-N-CA 124.591 1.156 . . . . 25.71 109.044 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -68.22 157.14 36.12 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 125.012 1.445 . . . . 61.41 109.736 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -152.42 131.49 12.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 106.704 -1.591 . . . . 28.2 106.704 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -110.51 123.24 49.55 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.174 -0.611 . . . . 86.6 110.418 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 151.53 39.35 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 113.137 0.791 . . . . 25.57 113.137 -172.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.52 -41.05 11.03 Favored 'General case' 0 C--O 1.216 -0.689 0 O-C-N 120.667 -1.271 . . . . 88.46 111.392 176.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.7 p -124.65 -162.58 1.1 Allowed 'General case' 0 CA--C 1.49 -1.328 0 CA-C-N 119.791 1.178 . . . . 33.99 109.46 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.251 12.2 pt-20 -77.93 -14.32 59.58 Favored 'General case' 0 CA--C 1.557 1.223 0 CA-C-O 121.979 0.895 . . . . 66.98 113.29 173.401 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -80.16 -39.58 29.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.999 -2.313 . . . . 30.6 111.625 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -81.29 170.31 16.21 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 120.04 -1.662 . . . . 24.99 107.284 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.7 tp -122.54 128.28 50.57 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 125.956 1.702 . . . . 29.23 110.317 -174.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.257 10.4 m -81.03 148.46 29.7 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 106.377 -1.712 . . . . 27.23 106.377 178.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -157.81 165.32 35.62 Favored 'General case' 0 C--O 1.255 1.363 0 N-CA-C 106.059 -1.83 . . . . 24.62 106.059 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -114.4 158.12 21.96 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.912 2.007 . . . . 30.97 110.598 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -55.89 142.65 34.59 Favored 'General case' 0 C--O 1.274 2.355 0 N-CA-C 108.165 -1.05 . . . . 80.79 108.165 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.39 -15.53 39.73 Favored Glycine 0 C--O 1.198 -2.144 0 O-C-N 125.303 1.627 . . . . 22.85 112.776 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . 0.512 ' OE2' ' OG ' ' A' ' 124' ' ' SER . 46.7 tt0 -59.07 142.68 50.73 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 119.294 -2.298 . . . . 33.07 109.184 174.917 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.79 147.85 37.61 Favored 'General case' 0 C--O 1.216 -0.662 0 O-C-N 119.007 -2.308 . . . . 52.2 108.844 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . 0.286 96.8 m-85 -133.43 153.13 51.86 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 126.408 2.318 . . . . 26.02 109.794 -174.653 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -106.17 131.51 53.34 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 104.419 -2.437 . . . . 77.76 104.419 166.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 35.4 mm -82.92 126.17 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-N 120.108 1.322 . . . . 29.07 113.948 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.1 mt -86.71 -46.68 9.8 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.397 1.628 . . . . 41.6 115.397 174.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -146.14 117.47 7.92 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-O 117.617 -1.182 . . . . 46.82 109.367 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.1 p -113.56 8.46 17.72 Favored 'General case' 0 N--CA 1.414 -2.244 0 O-C-N 128.39 3.556 . . . . 40.37 115.461 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.0 p -112.47 2.45 16.36 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 114.078 1.14 . . . . 72.55 114.078 -169.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -90.11 1.3 56.54 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 115.018 -0.992 . . . . 63.23 113.502 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 141.78 -168.72 25.5 Favored Glycine 0 N--CA 1.432 -1.607 0 C-N-CA 116.697 -2.668 . . . . 37.81 111.864 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -87.2 -6.96 58.41 Favored 'General case' 0 CA--C 1.485 -1.553 0 C-N-CA 116.403 -2.119 . . . . 69.45 112.362 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -96.05 124.05 39.9 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.259 -1.386 . . . . 29.16 107.259 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 53.3 m0 -108.0 139.95 41.88 Favored 'General case' 0 CA--C 1.481 -1.681 0 O-C-N 121.002 -1.061 . . . . 28.63 111.535 -173.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.61 122.02 27.07 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 120.227 -0.589 . . . . 100.0 109.924 176.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.29 155.6 45.96 Favored 'General case' 0 C--O 1.207 -1.139 0 O-C-N 120.865 -1.147 . . . . 26.02 109.131 -168.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -110.08 125.82 53.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.927 -1.138 . . . . 45.66 107.927 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . 0.512 ' OG ' ' OE2' ' A' ' 107' ' ' GLU . 44.2 t -68.41 129.1 38.92 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 122.57 1.176 . . . . 24.85 111.514 171.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.57 -15.62 59.81 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 113.388 -1.733 . . . . 36.62 108.357 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.5 m -80.03 -44.42 20.17 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 117.047 2.24 . . . . 53.16 117.047 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 72.6 p -125.36 -9.64 6.94 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 124.066 1.889 . . . . 37.66 110.246 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 124' ' ' SER . . . 81.34 -8.92 57.07 Favored Glycine 0 N--CA 1.426 -2.022 1 C-N-CA 108.85 -6.405 . . . . 28.62 113.186 178.941 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.55 153.44 27.56 Favored 'General case' 0 C--O 1.273 2.293 0 CA-C-O 125.717 2.675 . . . . 76.65 116.137 168.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.0 m -127.51 144.54 51.05 Favored 'General case' 0 C--O 1.184 -2.36 0 CA-C-N 113.253 -1.794 . . . . 33.13 110.559 -173.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.71 179.89 41.18 Favored Glycine 0 N--CA 1.502 3.05 0 N-CA-C 108.159 -1.977 . . . . 23.88 108.159 -177.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . 0.251 36.2 m-85 -89.91 144.26 26.08 Favored 'General case' 0 C--N 1.365 1.277 0 N-CA-C 107.167 -1.42 . . . . 56.16 107.167 -177.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 20.8 pt -132.2 150.71 76.77 Favored Pre-proline 0 C--N 1.311 -1.071 0 O-C-N 126.812 2.57 . . . . 25.02 105.534 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -75.41 123.19 7.48 Favored 'Trans proline' 0 N--CA 1.446 -1.287 0 N-CA-C 105.607 -2.497 . . . . 22.4 105.607 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 83.5 p -66.36 -16.66 64.24 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-O 117.563 -1.208 . . . . 24.14 113.407 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -85.21 1.11 49.57 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.035 1.743 . . . . 24.17 106.565 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -96.7 0.46 49.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.91 -0.716 . . . . 51.13 112.868 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 34.0 m -129.44 155.4 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 118.652 -1.219 . . . . 27.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -132.96 157.25 78.85 Favored Pre-proline 0 C--O 1.26 1.658 0 N-CA-C 109.253 -0.647 . . . . 19.76 109.253 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -68.24 139.66 46.66 Favored 'Trans proline' 0 CA--C 1.486 -1.876 0 N-CA-C 110.797 -0.501 . . . . 26.54 110.797 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 22.1 t -68.4 136.06 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 117.475 -1.25 . . . . 51.59 109.859 -174.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . 0.332 87.5 m-20 . . . . . 0 C--O 1.257 1.483 0 N-CA-C 118.133 2.642 . . . . 100.0 118.133 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--O 1.245 0.836 0 CA-C-O 121.602 0.715 . . . . 52.54 112.717 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 67.2 p -129.84 -4.42 4.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 112.394 -3.722 . . . . 34.0 112.063 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.45 125.51 40.99 Favored 'General case' 0 CA--C 1.564 1.508 0 O-C-N 121.541 -0.724 . . . . 52.57 110.713 -177.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -132.3 150.79 52.08 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.342 -1.474 . . . . 29.01 107.587 -175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 5.6 p -118.88 145.19 25.28 Favored 'Isoleucine or valine' 0 C--O 1.271 2.193 0 N-CA-C 106.294 -1.743 . . . . 23.08 106.294 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.36 133.51 41.19 Favored 'General case' 0 C--O 1.254 1.327 0 CA-C-O 123.536 1.636 . . . . 20.64 112.8 176.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 23.6 mt -84.97 -28.95 25.47 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 115.876 -2.012 . . . . 31.99 111.049 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -141.01 165.61 27.06 Favored 'General case' 0 C--O 1.195 -1.77 0 CA-C-O 115.161 -2.352 . . . . 39.14 110.115 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -76.26 161.24 28.92 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 121.94 2.155 . . . . 44.54 109.84 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -153.34 129.22 10.22 Favored 'General case' 0 CA--C 1.484 -1.595 0 C-N-CA 118.854 -1.138 . . . . 43.77 109.773 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -104.63 112.94 26.21 Favored 'General case' 0 C--O 1.219 -0.514 0 O-C-N 124.446 1.091 . . . . 83.63 109.948 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -56.53 142.52 38.86 Favored 'General case' 0 C--O 1.194 -1.859 0 O-C-N 119.354 -2.091 . . . . 40.49 112.802 -172.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.55 -28.41 21.99 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 125.549 1.539 . . . . 100.0 111.79 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 44.6 p -136.7 178.42 7.08 Favored 'General case' 0 C--O 1.199 -1.561 0 O-C-N 120.391 -1.443 . . . . 48.6 110.3 -173.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.26 -24.88 57.67 Favored 'General case' 0 C--O 1.193 -1.88 0 O-C-N 119.434 -2.041 . . . . 100.0 111.898 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -87.1 -9.14 56.12 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 118.539 -2.6 . . . . 64.23 115.252 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . 0.292 59.3 m-20 -88.37 156.38 19.18 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 104.872 -2.269 . . . . 40.11 104.872 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 56.0 tp -103.66 130.12 51.08 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.293 -1.373 . . . . 38.0 107.293 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 56.6 m -82.69 155.09 24.52 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 121.225 1.83 . . . . 33.11 108.153 171.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -161.72 174.43 13.26 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 117.154 -1.818 . . . . 35.87 109.132 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -121.19 150.65 40.99 Favored 'General case' 0 C--O 1.25 1.107 0 CA-C-O 123.998 1.856 . . . . 25.69 111.545 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.97 141.31 34.31 Favored 'General case' 0 N--CA 1.412 -2.374 0 C-N-CA 117.512 -1.675 . . . . 77.51 109.956 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 92.21 -14.09 65.44 Favored Glycine 0 CA--C 1.543 1.786 0 CA-C-O 121.828 0.682 . . . . 23.5 111.853 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -69.82 142.04 53.19 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-O 123.301 1.524 . . . . 24.38 110.574 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -110.56 153.23 25.43 Favored 'General case' 0 C--N 1.372 1.567 0 CA-C-O 117.725 -1.131 . . . . 65.14 109.128 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -134.44 158.48 43.77 Favored 'General case' 0 C--N 1.367 1.349 0 O-C-N 126.514 2.384 . . . . 25.32 111.166 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -100.17 129.1 46.15 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 115.654 -2.418 . . . . 30.53 105.074 162.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 19.4 mt -128.11 102.35 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 107.669 -1.234 . . . . 26.64 107.669 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.1 -57.87 4.46 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 118.763 -1.175 . . . . 36.39 113.719 -174.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -120.67 134.17 55.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.968 1.366 . . . . 41.0 109.95 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 18.9 p -70.78 155.81 40.31 Favored 'General case' 0 CA--C 1.592 2.585 0 O-C-N 118.793 -2.442 . . . . 55.3 112.909 168.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 3.4 p -88.86 178.09 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 117.013 -3.555 . . . . 48.49 109.307 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.74 -10.74 59.7 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 125.595 1.809 . . . . 54.52 111.789 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -118.09 -160.5 11.61 Favored Glycine 0 C--N 1.363 2.041 0 C-N-CA 125.807 1.67 . . . . 43.03 110.544 -175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.314 36.3 m-20 -92.53 1.1 57.44 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 120.892 -1.358 . . . . 33.73 109.704 -174.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -115.86 129.09 56.28 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 119.437 -2.039 . . . . 30.67 109.422 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -120.65 148.75 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.185 -1.043 . . . . 30.27 108.185 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -91.57 120.85 32.72 Favored 'General case' 0 C--O 1.251 1.159 0 N-CA-C 107.51 -1.293 . . . . 65.02 107.51 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -127.04 159.72 33.3 Favored 'General case' 0 C--O 1.25 1.128 0 C-N-CA 119.215 -0.994 . . . . 21.92 110.676 -170.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.99 129.85 54.48 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.176 -1.416 . . . . 57.97 107.176 170.662 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.6 t -79.92 132.29 36.03 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.899 -1.148 . . . . 18.92 107.899 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.55 -2.87 31.08 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 113.68 0.993 . . . . 29.7 113.68 169.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 98.2 m -98.05 -55.21 2.85 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 118.024 -1.47 . . . . 25.19 110.236 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 56.5 p -97.78 -14.36 20.84 Favored 'General case' 0 C--O 1.188 -2.17 0 O-C-N 119.758 -1.839 . . . . 25.14 109.678 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 79.54 -1.61 76.49 Favored Glycine 0 C--N 1.29 -2.022 0 C-N-CA 116.709 -2.662 . . . . 29.28 112.563 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.92 161.85 22.94 Favored 'General case' 0 C--N 1.293 -1.89 0 C-N-CA 116.651 -2.019 . . . . 92.27 115.082 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 10.0 t -130.4 148.86 52.26 Favored 'General case' 0 N--CA 1.413 -2.303 0 O-C-N 120.489 -1.382 . . . . 29.95 112.435 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.24 173.4 36.13 Favored Glycine 0 C--O 1.192 -2.51 0 CA-C-O 117.973 -1.459 . . . . 21.88 109.577 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -77.89 148.7 34.46 Favored 'General case' 0 C--O 1.259 1.583 0 N-CA-C 107.962 -1.125 . . . . 44.73 107.962 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 44.7 pt -137.71 154.62 74.96 Favored Pre-proline 0 N--CA 1.488 1.462 0 N-CA-C 106.42 -1.696 . . . . 24.77 106.42 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -77.45 126.98 8.7 Favored 'Trans proline' 0 N--CA 1.445 -1.369 0 N-CA-C 108.045 -1.56 . . . . 25.37 108.045 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 96.3 p -68.18 -19.11 64.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.657 -1.277 . . . . 30.6 114.015 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -78.15 -8.16 57.93 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.315 1.01 . . . . 25.07 110.916 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -90.56 0.66 57.27 Favored 'General case' 0 C--O 1.205 -1.269 0 O-C-N 120.837 -1.164 . . . . 32.32 113.81 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.27 163.34 36.15 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.735 0 O-C-N 118.827 -2.421 . . . . 25.07 109.401 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.36 152.14 63.15 Favored Pre-proline 0 C--O 1.266 1.952 0 O-C-N 120.144 -1.598 . . . . 22.94 107.104 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.05 135.77 56.97 Favored 'Trans proline' 0 CA--C 1.504 -1.01 0 O-C-N 123.43 1.226 . . . . 35.05 109.49 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 4.3 t -75.17 123.9 31.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-O 117.995 -1.002 . . . . 57.09 108.617 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 . . . . . 0 C--O 1.28 2.706 0 O-C-N 126.055 2.097 . . . . 100.0 110.093 -178.095 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 81.9 t . . . . . 0 N--CA 1.445 -0.698 0 CA-C-O 122.394 1.092 . . . . 100.0 110.055 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.8 m -125.17 142.09 51.71 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 102.882 -3.007 . . . . 82.15 102.882 173.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 73.7 mt -78.59 158.11 28.56 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 114.991 -2.684 . . . . 46.43 107.738 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -123.16 157.04 33.85 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 106.642 -1.614 . . . . 27.74 106.642 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.8 139.97 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 120.312 1.414 . . . . 20.89 108.288 -177.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.56 132.29 47.28 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-O 117.705 -1.14 . . . . 20.71 111.718 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.3 mt -86.33 -26.27 24.97 Favored 'General case' 0 C--O 1.25 1.087 0 O-C-N 125.388 1.68 . . . . 24.77 114.183 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -145.03 164.14 32.09 Favored 'General case' 0 CA--C 1.483 -1.612 0 C-N-CA 124.591 1.156 . . . . 25.71 109.044 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -68.22 157.14 36.12 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 125.012 1.445 . . . . 61.41 109.736 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -152.42 131.49 12.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 106.704 -1.591 . . . . 28.2 106.704 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -110.51 123.24 49.55 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.174 -0.611 . . . . 86.6 110.418 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 151.53 39.35 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 113.137 0.791 . . . . 25.57 113.137 -172.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . 0.412 ' HG3' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -91.52 -41.05 11.03 Favored 'General case' 0 C--O 1.216 -0.689 0 O-C-N 120.667 -1.271 . . . . 88.46 111.392 176.912 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.7 p -124.65 -162.58 1.1 Allowed 'General case' 0 CA--C 1.49 -1.328 0 CA-C-N 119.791 1.178 . . . . 33.99 109.46 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.251 12.2 pt-20 -77.93 -14.32 59.58 Favored 'General case' 0 CA--C 1.557 1.223 0 CA-C-O 121.979 0.895 . . . . 66.98 113.29 173.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -80.16 -39.58 29.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.999 -2.313 . . . . 30.6 111.625 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -81.29 170.31 16.21 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 120.04 -1.662 . . . . 24.99 107.284 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.7 tp -122.54 128.28 50.57 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 125.956 1.702 . . . . 29.23 110.317 -174.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.257 10.4 m -81.03 148.46 29.7 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 106.377 -1.712 . . . . 27.23 106.377 178.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -157.81 165.32 35.62 Favored 'General case' 0 C--O 1.255 1.363 0 N-CA-C 106.059 -1.83 . . . . 24.62 106.059 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -114.4 158.12 21.96 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.912 2.007 . . . . 30.97 110.598 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -55.89 142.65 34.59 Favored 'General case' 0 C--O 1.274 2.355 0 N-CA-C 108.165 -1.05 . . . . 80.79 108.165 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.39 -15.53 39.73 Favored Glycine 0 C--O 1.198 -2.144 0 O-C-N 125.303 1.627 . . . . 22.85 112.776 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -59.07 142.68 50.73 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 119.294 -2.298 . . . . 33.07 109.184 174.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.79 147.85 37.61 Favored 'General case' 0 C--O 1.216 -0.662 0 O-C-N 119.007 -2.308 . . . . 52.2 108.844 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . 0.286 96.8 m-85 -133.43 153.13 51.86 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 126.408 2.318 . . . . 26.02 109.794 -174.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -106.17 131.51 53.34 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 104.419 -2.437 . . . . 77.76 104.419 166.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 35.4 mm -82.92 126.17 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-N 120.108 1.322 . . . . 29.07 113.948 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.1 mt -86.71 -46.68 9.8 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.397 1.628 . . . . 41.6 115.397 174.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -146.14 117.47 7.92 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-O 117.617 -1.182 . . . . 46.82 109.367 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.1 p -113.56 8.46 17.72 Favored 'General case' 0 N--CA 1.414 -2.244 0 O-C-N 128.39 3.556 . . . . 40.37 115.461 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.0 p -112.47 2.45 16.36 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 114.078 1.14 . . . . 72.55 114.078 -169.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -90.11 1.3 56.54 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 115.018 -0.992 . . . . 63.23 113.502 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 141.78 -168.72 25.5 Favored Glycine 0 N--CA 1.432 -1.607 0 C-N-CA 116.697 -2.668 . . . . 37.81 111.864 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -87.2 -6.96 58.41 Favored 'General case' 0 CA--C 1.485 -1.553 0 C-N-CA 116.403 -2.119 . . . . 69.45 112.362 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -96.05 124.05 39.9 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.259 -1.386 . . . . 29.16 107.259 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . 0.422 ' O ' ' HA ' ' A' ' 132' ' ' TYR . 53.3 m0 -108.0 139.95 41.88 Favored 'General case' 0 CA--C 1.481 -1.681 0 O-C-N 121.002 -1.061 . . . . 28.63 111.535 -173.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.61 122.02 27.07 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 120.227 -0.589 . . . . 100.0 109.924 176.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.29 155.6 45.96 Favored 'General case' 0 C--O 1.207 -1.139 0 O-C-N 120.865 -1.147 . . . . 26.02 109.131 -168.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -110.08 125.82 53.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.927 -1.138 . . . . 45.66 107.927 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 44.2 t -68.41 129.1 38.92 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 122.57 1.176 . . . . 24.85 111.514 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.57 -15.62 59.81 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 113.388 -1.733 . . . . 36.62 108.357 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.5 m -80.03 -44.42 20.17 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 117.047 2.24 . . . . 53.16 117.047 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 72.6 p -125.36 -9.64 6.94 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 124.066 1.889 . . . . 37.66 110.246 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 81.34 -8.92 57.07 Favored Glycine 0 N--CA 1.426 -2.022 1 C-N-CA 108.85 -6.405 . . . . 28.62 113.186 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.55 153.44 27.56 Favored 'General case' 0 C--O 1.273 2.293 0 CA-C-O 125.717 2.675 . . . . 76.65 116.137 168.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.0 m -127.51 144.54 51.05 Favored 'General case' 0 C--O 1.184 -2.36 0 CA-C-N 113.253 -1.794 . . . . 33.13 110.559 -173.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.71 179.89 41.18 Favored Glycine 0 N--CA 1.502 3.05 0 N-CA-C 108.159 -1.977 . . . . 23.88 108.159 -177.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 120' ' ' TRP 0.251 36.2 m-85 -89.91 144.26 26.08 Favored 'General case' 0 C--N 1.365 1.277 0 N-CA-C 107.167 -1.42 . . . . 56.16 107.167 -177.21 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 20.8 pt -132.2 150.71 76.77 Favored Pre-proline 0 C--N 1.311 -1.071 0 O-C-N 126.812 2.57 . . . . 25.02 105.534 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -75.41 123.19 7.48 Favored 'Trans proline' 0 N--CA 1.446 -1.287 0 N-CA-C 105.607 -2.497 . . . . 22.4 105.607 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 83.5 p -66.36 -16.66 64.24 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-O 117.563 -1.208 . . . . 24.14 113.407 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -85.21 1.11 49.57 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.035 1.743 . . . . 24.17 106.565 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -96.7 0.46 49.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.91 -0.716 . . . . 51.13 112.868 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 34.0 m -129.44 155.4 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 118.652 -1.219 . . . . 27.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -132.96 157.25 78.85 Favored Pre-proline 0 C--O 1.26 1.658 0 N-CA-C 109.253 -0.647 . . . . 19.76 109.253 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -68.24 139.66 46.66 Favored 'Trans proline' 0 CA--C 1.486 -1.876 0 N-CA-C 110.797 -0.501 . . . . 26.54 110.797 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . 0.422 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 22.1 t -68.4 136.06 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 117.475 -1.25 . . . . 51.59 109.859 -174.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 141' ' ' VAL 0.332 87.5 m-20 . . . . . 0 C--O 1.257 1.483 0 N-CA-C 118.133 2.642 . . . . 100.0 118.133 -175.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--O 1.245 0.836 0 CA-C-O 121.602 0.715 . . . . 52.54 112.717 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 67.2 p -129.84 -4.42 4.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 112.394 -3.722 . . . . 34.0 112.063 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.45 125.51 40.99 Favored 'General case' 0 CA--C 1.564 1.508 0 O-C-N 121.541 -0.724 . . . . 52.57 110.713 -177.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -132.3 150.79 52.08 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.342 -1.474 . . . . 29.01 107.587 -175.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 5.6 p -118.88 145.19 25.28 Favored 'Isoleucine or valine' 0 C--O 1.271 2.193 0 N-CA-C 106.294 -1.743 . . . . 23.08 106.294 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.36 133.51 41.19 Favored 'General case' 0 C--O 1.254 1.327 0 CA-C-O 123.536 1.636 . . . . 20.64 112.8 176.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 23.6 mt -84.97 -28.95 25.47 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 115.876 -2.012 . . . . 31.99 111.049 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -141.01 165.61 27.06 Favored 'General case' 0 C--O 1.195 -1.77 0 CA-C-O 115.161 -2.352 . . . . 39.14 110.115 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -76.26 161.24 28.92 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 121.94 2.155 . . . . 44.54 109.84 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -153.34 129.22 10.22 Favored 'General case' 0 CA--C 1.484 -1.595 0 C-N-CA 118.854 -1.138 . . . . 43.77 109.773 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -104.63 112.94 26.21 Favored 'General case' 0 C--O 1.219 -0.514 0 O-C-N 124.446 1.091 . . . . 83.63 109.948 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' B' ' 100' ' ' ASP . . . -56.53 142.52 38.86 Favored 'General case' 0 C--O 1.194 -1.859 0 O-C-N 119.354 -2.091 . . . . 40.49 112.802 -172.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.55 -28.41 21.99 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 125.549 1.539 . . . . 100.0 111.79 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 44.6 p -136.7 178.42 7.08 Favored 'General case' 0 C--O 1.199 -1.561 0 O-C-N 120.391 -1.443 . . . . 48.6 110.3 -173.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.26 -24.88 57.67 Favored 'General case' 0 C--O 1.193 -1.88 0 O-C-N 119.434 -2.041 . . . . 100.0 111.898 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -87.1 -9.14 56.12 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 118.539 -2.6 . . . . 64.23 115.252 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . 0.469 ' HB2' ' HB1' ' B' ' 95' ' ' ALA 0.292 59.3 m-20 -88.37 156.38 19.18 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 104.872 -2.269 . . . . 40.11 104.872 -176.378 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 56.0 tp -103.66 130.12 51.08 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.293 -1.373 . . . . 38.0 107.293 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 56.6 m -82.69 155.09 24.52 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 121.225 1.83 . . . . 33.11 108.153 171.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -161.72 174.43 13.26 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 117.154 -1.818 . . . . 35.87 109.132 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -121.19 150.65 40.99 Favored 'General case' 0 C--O 1.25 1.107 0 CA-C-O 123.998 1.856 . . . . 25.69 111.545 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.97 141.31 34.31 Favored 'General case' 0 N--CA 1.412 -2.374 0 C-N-CA 117.512 -1.675 . . . . 77.51 109.956 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 92.21 -14.09 65.44 Favored Glycine 0 CA--C 1.543 1.786 0 CA-C-O 121.828 0.682 . . . . 23.5 111.853 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -69.82 142.04 53.19 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-O 123.301 1.524 . . . . 24.38 110.574 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -110.56 153.23 25.43 Favored 'General case' 0 C--N 1.372 1.567 0 CA-C-O 117.725 -1.131 . . . . 65.14 109.128 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -134.44 158.48 43.77 Favored 'General case' 0 C--N 1.367 1.349 0 O-C-N 126.514 2.384 . . . . 25.32 111.166 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -100.17 129.1 46.15 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 115.654 -2.418 . . . . 30.53 105.074 162.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 19.4 mt -128.11 102.35 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 107.669 -1.234 . . . . 26.64 107.669 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.1 -57.87 4.46 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 118.763 -1.175 . . . . 36.39 113.719 -174.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -120.67 134.17 55.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.968 1.366 . . . . 41.0 109.95 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 18.9 p -70.78 155.81 40.31 Favored 'General case' 0 CA--C 1.592 2.585 0 O-C-N 118.793 -2.442 . . . . 55.3 112.909 168.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 3.4 p -88.86 178.09 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 117.013 -3.555 . . . . 48.49 109.307 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.74 -10.74 59.7 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 125.595 1.809 . . . . 54.52 111.789 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -118.09 -160.5 11.61 Favored Glycine 0 C--N 1.363 2.041 0 C-N-CA 125.807 1.67 . . . . 43.03 110.544 -175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.314 36.3 m-20 -92.53 1.1 57.44 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 120.892 -1.358 . . . . 33.73 109.704 -174.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -115.86 129.09 56.28 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 119.437 -2.039 . . . . 30.67 109.422 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -120.65 148.75 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.185 -1.043 . . . . 30.27 108.185 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -91.57 120.85 32.72 Favored 'General case' 0 C--O 1.251 1.159 0 N-CA-C 107.51 -1.293 . . . . 65.02 107.51 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -127.04 159.72 33.3 Favored 'General case' 0 C--O 1.25 1.128 0 C-N-CA 119.215 -0.994 . . . . 21.92 110.676 -170.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.99 129.85 54.48 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.176 -1.416 . . . . 57.97 107.176 170.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.6 t -79.92 132.29 36.03 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.899 -1.148 . . . . 18.92 107.899 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.55 -2.87 31.08 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 113.68 0.993 . . . . 29.7 113.68 169.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 98.2 m -98.05 -55.21 2.85 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 118.024 -1.47 . . . . 25.19 110.236 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 56.5 p -97.78 -14.36 20.84 Favored 'General case' 0 C--O 1.188 -2.17 0 O-C-N 119.758 -1.839 . . . . 25.14 109.678 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 79.54 -1.61 76.49 Favored Glycine 0 C--N 1.29 -2.022 0 C-N-CA 116.709 -2.662 . . . . 29.28 112.563 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.92 161.85 22.94 Favored 'General case' 0 C--N 1.293 -1.89 0 C-N-CA 116.651 -2.019 . . . . 92.27 115.082 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 10.0 t -130.4 148.86 52.26 Favored 'General case' 0 N--CA 1.413 -2.303 0 O-C-N 120.489 -1.382 . . . . 29.95 112.435 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.24 173.4 36.13 Favored Glycine 0 C--O 1.192 -2.51 0 CA-C-O 117.973 -1.459 . . . . 21.88 109.577 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -77.89 148.7 34.46 Favored 'General case' 0 C--O 1.259 1.583 0 N-CA-C 107.962 -1.125 . . . . 44.73 107.962 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 44.7 pt -137.71 154.62 74.96 Favored Pre-proline 0 N--CA 1.488 1.462 0 N-CA-C 106.42 -1.696 . . . . 24.77 106.42 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -77.45 126.98 8.7 Favored 'Trans proline' 0 N--CA 1.445 -1.369 0 N-CA-C 108.045 -1.56 . . . . 25.37 108.045 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 96.3 p -68.18 -19.11 64.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.657 -1.277 . . . . 30.6 114.015 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -78.15 -8.16 57.93 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.315 1.01 . . . . 25.07 110.916 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -90.56 0.66 57.27 Favored 'General case' 0 C--O 1.205 -1.269 0 O-C-N 120.837 -1.164 . . . . 32.32 113.81 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.27 163.34 36.15 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.735 0 O-C-N 118.827 -2.421 . . . . 25.07 109.401 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.36 152.14 63.15 Favored Pre-proline 0 C--O 1.266 1.952 0 O-C-N 120.144 -1.598 . . . . 22.94 107.104 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.05 135.77 56.97 Favored 'Trans proline' 0 CA--C 1.504 -1.01 0 O-C-N 123.43 1.226 . . . . 35.05 109.49 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 4.3 t -75.17 123.9 31.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-O 117.995 -1.002 . . . . 57.09 108.617 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 . . . . . 0 C--O 1.28 2.706 0 O-C-N 126.055 2.097 . . . . 100.0 110.093 -178.095 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 81.9 t . . . . . 0 N--CA 1.445 -0.698 0 CA-C-O 122.394 1.092 . . . . 100.0 110.055 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 1.8 m -125.17 142.09 51.71 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 102.882 -3.007 . . . . 82.150000000000006 102.882 173.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 73.7 mt -78.59 158.11 28.56 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 114.991 -2.684 . . . . 46.43 107.738 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -123.16 157.04 33.85 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 106.642 -1.614 . . . . 27.739999999999998 106.642 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.8 139.97 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-N 120.312 1.414 . . . . 20.890000000000001 108.288 -177.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.56 132.29 47.28 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-O 117.705 -1.14 . . . . 20.710000000000001 111.718 -178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 29.3 mt -86.33 -26.27 24.97 Favored 'General case' 0 C--O 1.25 1.087 0 O-C-N 125.388 1.68 . . . . 24.77 114.183 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -145.03 164.14 32.09 Favored 'General case' 0 CA--C 1.483 -1.612 0 C-N-CA 124.591 1.156 . . . . 25.710000000000001 109.044 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -68.22 157.14 36.12 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 125.012 1.445 . . . . 61.409999999999997 109.736 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -152.42 131.49 12.65 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 106.704 -1.591 . . . . 28.199999999999999 106.704 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -110.51 123.24 49.55 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 120.174 -0.611 . . . . 86.599999999999994 110.418 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.97 151.53 39.35 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 113.137 0.791 . . . . 25.57 113.137 -172.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.412 HH11 ' HG3' ' A' ' 96' ' ' ARG . 0.0 OUTLIER -91.52 -41.05 11.03 Favored 'General case' 0 C--O 1.216 -0.689 0 O-C-N 120.667 -1.271 . . . . 88.459999999999994 111.392 176.912 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 54.7 p -124.65 -162.58 1.1 Allowed 'General case' 0 CA--C 1.49 -1.328 0 CA-C-N 119.791 1.178 . . . . 33.990000000000002 109.46 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . 0.251 12.2 pt-20 -77.93 -14.32 59.58 Favored 'General case' 0 CA--C 1.557 1.223 0 CA-C-O 121.979 0.895 . . . . 66.980000000000004 113.29 173.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -80.16 -39.58 29.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.999 -2.313 . . . . 30.600000000000001 111.625 -175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -81.29 170.31 16.21 Favored 'General case' 0 C--O 1.204 -1.309 0 O-C-N 120.04 -1.662 . . . . 24.989999999999998 107.284 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.7 tp -122.54 128.28 50.57 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 125.956 1.702 . . . . 29.23 110.317 -174.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.257 10.4 m -81.03 148.46 29.7 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 106.377 -1.712 . . . . 27.23 106.377 178.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -157.81 165.32 35.62 Favored 'General case' 0 C--O 1.255 1.363 0 N-CA-C 106.059 -1.83 . . . . 24.620000000000001 106.059 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 72.5 m-70 -114.4 158.12 21.96 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 125.912 2.007 . . . . 30.969999999999999 110.598 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -55.89 142.65 34.59 Favored 'General case' 0 C--O 1.274 2.355 0 N-CA-C 108.165 -1.05 . . . . 80.790000000000006 108.165 -179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.39 -15.53 39.73 Favored Glycine 0 C--O 1.198 -2.144 0 O-C-N 125.303 1.627 . . . . 22.850000000000001 112.776 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -59.07 142.68 50.73 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 119.294 -2.298 . . . . 33.07 109.184 174.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 46.1 mttp -113.79 147.85 37.61 Favored 'General case' 0 C--O 1.216 -0.662 0 O-C-N 119.007 -2.308 . . . . 52.200000000000003 108.844 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . 0.286 96.8 m-85 -133.43 153.13 51.86 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 126.408 2.318 . . . . 26.02 109.794 -174.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -106.17 131.51 53.34 Favored 'General case' 0 N--CA 1.425 -1.682 0 N-CA-C 104.419 -2.437 . . . . 77.760000000000005 104.419 166.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 35.4 mm -82.92 126.17 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 CA-C-N 120.108 1.322 . . . . 29.07 113.948 -177.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.1 mt -86.71 -46.68 9.8 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 115.397 1.628 . . . . 41.600000000000001 115.397 174.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -146.14 117.47 7.92 Favored 'General case' 0 CA--C 1.477 -1.842 0 CA-C-O 117.617 -1.182 . . . . 46.82 109.367 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 88.1 p -113.56 8.46 17.72 Favored 'General case' 0 N--CA 1.414 -2.244 0 O-C-N 128.39 3.556 . . . . 40.369999999999997 115.461 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.0 p -112.47 2.45 16.36 Favored 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 114.078 1.14 . . . . 72.549999999999997 114.078 -169.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -90.11 1.3 56.54 Favored 'General case' 0 N--CA 1.42 -1.969 0 CA-C-N 115.018 -0.992 . . . . 63.229999999999997 113.502 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 141.78 -168.72 25.5 Favored Glycine 0 N--CA 1.432 -1.607 0 C-N-CA 116.697 -2.668 . . . . 37.810000000000002 111.864 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -87.2 -6.96 58.41 Favored 'General case' 0 CA--C 1.485 -1.553 0 C-N-CA 116.403 -2.119 . . . . 69.450000000000003 112.362 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -96.05 124.05 39.9 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 107.259 -1.386 . . . . 29.16 107.259 173.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.422 ' O ' ' HA ' ' A' ' 132' ' ' TYR . 53.3 m0 -108.0 139.95 41.88 Favored 'General case' 0 CA--C 1.481 -1.681 0 O-C-N 121.002 -1.061 . . . . 28.629999999999999 111.535 -173.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.61 122.02 27.07 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 120.227 -0.589 . . . . 100.0 109.924 176.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -141.29 155.6 45.96 Favored 'General case' 0 C--O 1.207 -1.139 0 O-C-N 120.865 -1.147 . . . . 26.02 109.131 -168.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.1 ttm-85 -110.08 125.82 53.37 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.927 -1.138 . . . . 45.659999999999997 107.927 175.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 44.2 t -68.41 129.1 38.92 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 122.57 1.176 . . . . 24.850000000000001 111.514 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.57 -15.62 59.81 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 113.388 -1.733 . . . . 36.619999999999997 108.357 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 74.5 m -80.03 -44.42 20.17 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 117.047 2.24 . . . . 53.159999999999997 117.047 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 72.6 p -125.36 -9.64 6.94 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 124.066 1.889 . . . . 37.659999999999997 110.246 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 81.34 -8.92 57.07 Favored Glycine 0 N--CA 1.426 -2.022 1 C-N-CA 108.85 -6.405 . . . . 28.620000000000001 113.186 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.55 153.44 27.56 Favored 'General case' 0 C--O 1.273 2.293 0 CA-C-O 125.717 2.675 . . . . 76.650000000000006 116.137 168.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.0 m -127.51 144.54 51.05 Favored 'General case' 0 C--O 1.184 -2.36 0 CA-C-N 113.253 -1.794 . . . . 33.130000000000003 110.559 -173.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.71 179.89 41.18 Favored Glycine 0 N--CA 1.502 3.05 0 N-CA-C 108.159 -1.977 . . . . 23.879999999999999 108.159 -177.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 120' ' ' TRP 0.251 36.2 m-85 -89.91 144.26 26.08 Favored 'General case' 0 C--N 1.365 1.277 0 N-CA-C 107.167 -1.42 . . . . 56.159999999999997 107.167 -177.21 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 20.8 pt -132.2 150.71 76.77 Favored Pre-proline 0 C--N 1.311 -1.071 0 O-C-N 126.812 2.57 . . . . 25.02 105.534 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -75.41 123.19 7.48 Favored 'Trans proline' 0 N--CA 1.446 -1.287 0 N-CA-C 105.607 -2.497 . . . . 22.399999999999999 105.607 -178.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 83.5 p -66.36 -16.66 64.24 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-O 117.563 -1.208 . . . . 24.140000000000001 113.407 -175.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -85.21 1.11 49.57 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 121.035 1.743 . . . . 24.170000000000002 106.565 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -96.7 0.46 49.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.91 -0.716 . . . . 51.130000000000003 112.868 178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 34.0 m -129.44 155.4 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 118.652 -1.219 . . . . 27.0 110.98 -175.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -132.96 157.25 78.85 Favored Pre-proline 0 C--O 1.26 1.658 0 N-CA-C 109.253 -0.647 . . . . 19.760000000000002 109.253 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -68.24 139.66 46.66 Favored 'Trans proline' 0 CA--C 1.486 -1.876 0 N-CA-C 110.797 -0.501 . . . . 26.539999999999999 110.797 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.422 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 22.1 t -68.4 136.06 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 117.475 -1.25 . . . . 51.590000000000003 109.859 -174.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 141' ' ' VAL 0.332 87.5 m-20 . . . . . 0 C--O 1.257 1.483 0 N-CA-C 118.133 2.642 . . . . 100.0 118.133 -175.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--O 1.245 0.836 0 CA-C-O 121.602 0.715 . . . . 52.539999999999999 112.717 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 67.2 p -129.84 -4.42 4.6 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 112.394 -3.722 . . . . 34.0 112.063 -178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.45 125.51 40.99 Favored 'General case' 0 CA--C 1.564 1.508 0 O-C-N 121.541 -0.724 . . . . 52.57 110.713 -177.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -132.3 150.79 52.08 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.342 -1.474 . . . . 29.010000000000002 107.587 -175.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' VAL . . . . . . . . . . . . . 5.6 p -118.88 145.19 25.28 Favored 'Isoleucine or valine' 0 C--O 1.271 2.193 0 N-CA-C 106.294 -1.743 . . . . 23.079999999999998 106.294 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.36 133.51 41.19 Favored 'General case' 0 C--O 1.254 1.327 0 CA-C-O 123.536 1.636 . . . . 20.640000000000001 112.8 176.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 23.6 mt -84.97 -28.95 25.47 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-O 115.876 -2.012 . . . . 31.989999999999998 111.049 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -141.01 165.61 27.06 Favored 'General case' 0 C--O 1.195 -1.77 0 CA-C-O 115.161 -2.352 . . . . 39.140000000000001 110.115 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -76.26 161.24 28.92 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 121.94 2.155 . . . . 44.539999999999999 109.84 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -153.34 129.22 10.22 Favored 'General case' 0 CA--C 1.484 -1.595 0 C-N-CA 118.854 -1.138 . . . . 43.770000000000003 109.773 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -104.63 112.94 26.21 Favored 'General case' 0 C--O 1.219 -0.514 0 O-C-N 124.446 1.091 . . . . 83.629999999999995 109.948 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' B' ' 100' ' ' ASP . . . -56.53 142.52 38.86 Favored 'General case' 0 C--O 1.194 -1.859 0 O-C-N 119.354 -2.091 . . . . 40.490000000000002 112.802 -172.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.55 -28.41 21.99 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 125.549 1.539 . . . . 100.0 111.79 -179.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' THR . . . . . . . . . . . . . 44.6 p -136.7 178.42 7.08 Favored 'General case' 0 C--O 1.199 -1.561 0 O-C-N 120.391 -1.443 . . . . 48.600000000000001 110.3 -173.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -75.26 -24.88 57.67 Favored 'General case' 0 C--O 1.193 -1.88 0 O-C-N 119.434 -2.041 . . . . 100.0 111.898 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -87.1 -9.14 56.12 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 118.539 -2.6 . . . . 64.230000000000004 115.252 -179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.469 ' HB2' ' HB1' ' B' ' 95' ' ' ALA 0.292 59.3 m-20 -88.37 156.38 19.18 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 104.872 -2.269 . . . . 40.109999999999999 104.872 -176.378 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 56.0 tp -103.66 130.12 51.08 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.293 -1.373 . . . . 38.0 107.293 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 56.6 m -82.69 155.09 24.52 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-N 121.225 1.83 . . . . 33.109999999999999 108.153 171.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -161.72 174.43 13.26 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 117.154 -1.818 . . . . 35.869999999999997 109.132 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -121.19 150.65 40.99 Favored 'General case' 0 C--O 1.25 1.107 0 CA-C-O 123.998 1.856 . . . . 25.690000000000001 111.545 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -54.97 141.31 34.31 Favored 'General case' 0 N--CA 1.412 -2.374 0 C-N-CA 117.512 -1.675 . . . . 77.510000000000005 109.956 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 92.21 -14.09 65.44 Favored Glycine 0 CA--C 1.543 1.786 0 CA-C-O 121.828 0.682 . . . . 23.5 111.853 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -69.82 142.04 53.19 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-O 123.301 1.524 . . . . 24.379999999999999 110.574 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt -110.56 153.23 25.43 Favored 'General case' 0 C--N 1.372 1.567 0 CA-C-O 117.725 -1.131 . . . . 65.140000000000001 109.128 -175.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -134.44 158.48 43.77 Favored 'General case' 0 C--N 1.367 1.349 0 O-C-N 126.514 2.384 . . . . 25.32 111.166 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -100.17 129.1 46.15 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 115.654 -2.418 . . . . 30.530000000000001 105.074 162.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ILE . . . . . . . . . . . . . 19.4 mt -128.11 102.35 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 107.669 -1.234 . . . . 26.640000000000001 107.669 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 89.9 mt -70.1 -57.87 4.46 Favored 'General case' 0 CA--C 1.501 -0.929 0 C-N-CA 118.763 -1.175 . . . . 36.390000000000001 113.719 -174.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -120.67 134.17 55.3 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.968 1.366 . . . . 41.0 109.95 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' SER . . . . . . . . . . . . . 18.9 p -70.78 155.81 40.31 Favored 'General case' 0 CA--C 1.592 2.585 0 O-C-N 118.793 -2.442 . . . . 55.299999999999997 112.909 168.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 3.4 p -88.86 178.09 6.52 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 117.013 -3.555 . . . . 48.490000000000002 109.307 179.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -77.74 -10.74 59.7 Favored 'General case' 0 N--CA 1.433 -1.292 0 O-C-N 125.595 1.809 . . . . 54.520000000000003 111.789 176.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -118.09 -160.5 11.61 Favored Glycine 0 C--N 1.363 2.041 0 C-N-CA 125.807 1.67 . . . . 43.030000000000001 110.544 -175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.314 36.3 m-20 -92.53 1.1 57.44 Favored 'General case' 0 C--N 1.316 -0.877 0 O-C-N 120.892 -1.358 . . . . 33.729999999999997 109.704 -174.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' TRP . . . . . . . . . . . . . 79.1 m95 -115.86 129.09 56.28 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 119.437 -2.039 . . . . 30.670000000000002 109.422 -174.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' TRP . . . . . . . . . . . . . 51.3 m0 -120.65 148.75 43.5 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.185 -1.043 . . . . 30.27 108.185 -175.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -91.57 120.85 32.72 Favored 'General case' 0 C--O 1.251 1.159 0 N-CA-C 107.51 -1.293 . . . . 65.019999999999996 107.51 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -127.04 159.72 33.3 Favored 'General case' 0 C--O 1.25 1.128 0 C-N-CA 119.215 -0.994 . . . . 21.920000000000002 110.676 -170.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.99 129.85 54.48 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.176 -1.416 . . . . 57.969999999999999 107.176 170.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' SER . . . . . . . . . . . . . 14.6 t -79.92 132.29 36.03 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 107.899 -1.148 . . . . 18.920000000000002 107.899 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 72.7 mt -75.55 -2.87 31.08 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 113.68 0.993 . . . . 29.699999999999999 113.68 169.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 98.2 m -98.05 -55.21 2.85 Favored 'General case' 0 N--CA 1.434 -1.259 0 C-N-CA 118.024 -1.47 . . . . 25.190000000000001 110.236 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' THR . . . . . . . . . . . . . 56.5 p -97.78 -14.36 20.84 Favored 'General case' 0 C--O 1.188 -2.17 0 O-C-N 119.758 -1.839 . . . . 25.140000000000001 109.678 -171.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 79.54 -1.61 76.49 Favored Glycine 0 C--N 1.29 -2.022 0 C-N-CA 116.709 -2.662 . . . . 29.280000000000001 112.563 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -81.92 161.85 22.94 Favored 'General case' 0 C--N 1.293 -1.89 0 C-N-CA 116.651 -2.019 . . . . 92.269999999999996 115.082 -179.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' THR . . . . . . . . . . . . . 10.0 t -130.4 148.86 52.26 Favored 'General case' 0 N--CA 1.413 -2.303 0 O-C-N 120.489 -1.382 . . . . 29.949999999999999 112.435 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLY . . . . . . . . . . . . . . . 168.24 173.4 36.13 Favored Glycine 0 C--O 1.192 -2.51 0 CA-C-O 117.973 -1.459 . . . . 21.879999999999999 109.577 -178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -77.89 148.7 34.46 Favored 'General case' 0 C--O 1.259 1.583 0 N-CA-C 107.962 -1.125 . . . . 44.729999999999997 107.962 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' ILE . . . . . . . . . . . . . 44.7 pt -137.71 154.62 74.96 Favored Pre-proline 0 N--CA 1.488 1.462 0 N-CA-C 106.42 -1.696 . . . . 24.77 106.42 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -77.45 126.98 8.7 Favored 'Trans proline' 0 N--CA 1.445 -1.369 0 N-CA-C 108.045 -1.56 . . . . 25.370000000000001 108.045 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 96.3 p -68.18 -19.11 64.76 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.657 -1.277 . . . . 30.600000000000001 114.015 -170.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -78.15 -8.16 57.93 Favored 'General case' 0 N--CA 1.483 1.225 0 O-C-N 124.315 1.01 . . . . 25.07 110.916 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -90.56 0.66 57.27 Favored 'General case' 0 C--O 1.205 -1.269 0 O-C-N 120.837 -1.164 . . . . 32.32 113.81 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 29.1 m -130.27 163.34 36.15 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.735 0 O-C-N 118.827 -2.421 . . . . 25.07 109.401 -177.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.36 152.14 63.15 Favored Pre-proline 0 C--O 1.266 1.952 0 O-C-N 120.144 -1.598 . . . . 22.940000000000001 107.104 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -62.05 135.77 56.97 Favored 'Trans proline' 0 CA--C 1.504 -1.01 0 O-C-N 123.43 1.226 . . . . 35.049999999999997 109.49 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' VAL . . . . . . . . . . . . . 4.3 t -75.17 123.9 31.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.268 0 CA-C-O 117.995 -1.002 . . . . 57.090000000000003 108.617 -175.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 . . . . . 0 C--O 1.28 2.706 0 O-C-N 126.055 2.097 . . . . 100.0 110.093 -178.095 . . . . . . . . 0 0 . 1 stop_ save_