data_1hda_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 1hda _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 ' 1' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.258 1.504 0 CA-C-O 117.699 -1.144 . . . . 45.9 109.917 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.25 123.9 27.86 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.751 3.157 . . . . 37.25 112.048 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 p -80.8 173.61 12.43 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 117.099 -1.841 . . . . 28.88 107.445 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -41.67 97.47 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.269 -1.382 . . . . 24.58 107.269 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.08 -43.55 95.4 Favored 'General case' 0 C--O 1.243 0.762 0 O-C-N 126.416 2.322 . . . . 22.59 112.644 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -59.5 -48.97 79.6 Favored 'General case' 0 C--O 1.246 0.897 0 O-C-N 127.189 2.806 . . . . 17.84 109.086 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -57.79 -43.98 85.99 Favored 'General case' 0 C--O 1.265 1.882 0 O-C-N 125.319 1.637 . . . . 26.58 111.663 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.94 -43.87 98.6 Favored Glycine 0 CA--C 1.542 1.735 0 CA-C-O 125.21 2.561 . . . . 17.19 111.317 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.95 -46.07 88.94 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 117.622 -3.281 . . . . 21.85 110.456 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -67.51 -44.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 O-C-N 126.01 2.068 . . . . 15.96 109.589 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -59.87 -45.48 92.34 Favored 'General case' 0 C--N 1.316 -0.868 0 O-C-N 125.169 1.543 . . . . 36.16 108.921 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -53.29 57.69 Favored 'General case' 0 C--N 1.315 -0.927 0 O-C-N 121.38 -0.825 . . . . 19.26 112.283 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.35 99.02 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 124.48 1.113 . . . . 21.02 111.522 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -67.0 -30.49 70.61 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 122.082 0.944 . . . . 24.73 109.03 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.76 -32.48 84.32 Favored Glycine 0 N--CA 1.469 0.873 0 CA-C-N 113.807 -1.542 . . . . 26.61 110.007 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 0.401 ' NZ ' ' OD2' ' A' ' 116' ' ' ASP . 0.0 OUTLIER -78.79 -24.88 44.34 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.191 -1.182 . . . . 55.34 111.213 -179.137 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -68.67 -47.22 77.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 124.497 2.094 . . . . 28.39 105.447 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 43.54 -120.26 2.89 Favored Glycine 0 C--N 1.319 -0.416 0 CA-C-N 112.717 -2.038 . . . . 31.23 111.888 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.35 -16.34 54.04 Favored Glycine 0 C--O 1.248 1.007 0 C-N-CA 126.496 1.998 . . . . 30.68 117.381 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -86.64 -3.79 59.08 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-O 116.127 -1.892 . . . . 42.05 115.653 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -55.73 6.44 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 128.169 3.418 . . . . 20.37 112.024 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.37 -42.8 78.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.282 0.633 . . . . 16.8 111.007 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -63.33 -44.22 95.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 117.818 -1.087 . . . . 46.64 113.204 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -66.95 -31.45 72.03 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 126.615 2.447 . . . . 24.99 110.12 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.7 -47.21 88.69 Favored Glycine 0 CA--C 1.531 1.053 0 O-C-N 125.588 1.805 . . . . 15.22 109.639 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -40.6 82.46 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 112.393 -1.904 . . . . 14.82 107.915 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -70.44 -39.15 74.54 Favored 'General case' 0 C--N 1.317 -0.81 0 O-C-N 123.576 0.547 . . . . 20.19 111.793 178.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.16 -42.02 94.02 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 119.779 -1.826 . . . . 10.06 110.265 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 53.3 mt -60.91 -49.53 77.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.204 -1.362 . . . . 11.87 110.584 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.84 -41.07 86.08 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 125.146 1.529 . . . . 40.71 109.778 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.6 mtt-85 -67.44 -39.23 85.41 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.437 -0.949 . . . . 16.39 108.437 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 52.6 ttp -60.68 -44.51 96.4 Favored 'General case' 0 C--O 1.249 1.062 0 CA-C-O 123.003 1.382 . . . . 12.26 111.294 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -64.01 -38.89 92.71 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-O 117.412 -1.28 . . . . 14.91 111.711 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -76.32 -46.2 28.77 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 126.679 2.487 . . . . 24.56 113.76 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.7 m -75.85 -30.49 58.95 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-O 115.543 -2.17 . . . . 22.62 111.934 -177.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -131.56 79.21 69.6 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 126.532 2.395 . . . . 16.63 110.805 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -57.24 -26.33 69.44 Favored 'Trans proline' 0 C--N 1.32 -0.94 0 C-N-CA 123.291 2.661 . . . . 14.94 115.109 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -61.88 -19.31 62.5 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 119.147 0.885 . . . . 12.21 112.535 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 p -69.3 -21.51 63.86 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 121.214 0.53 . . . . 11.82 111.318 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -67.79 -18.05 64.73 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 117.194 -1.384 . . . . 16.8 112.171 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.1 p -65.99 -15.33 62.92 Favored 'General case' 0 C--O 1.256 1.423 0 O-C-N 125.754 1.908 . . . . 14.6 111.595 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -91.38 -5.29 54.71 Favored 'General case' 0 C--O 1.254 1.299 0 O-C-N 125.066 1.478 . . . . 16.09 113.431 178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.76 58.13 34.04 Favored Pre-proline 0 N--CA 1.482 1.167 0 O-C-N 124.736 1.272 . . . . 18.72 110.278 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.0 -18.9 52.19 Favored 'Trans proline' 0 C--O 1.243 0.75 0 CA-C-O 116.203 -1.665 . . . . 21.3 113.423 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -114.76 25.62 10.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.173 1.546 . . . . 38.87 115.173 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.62 145.86 29.73 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 128.607 3.692 . . . . 23.04 107.499 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -87.66 107.45 18.63 Favored 'General case' 0 C--N 1.31 -1.109 1 N-CA-C 97.912 -4.848 . . . . 36.13 97.912 171.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.07 9.88 40.87 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 125.097 1.498 . . . . 30.11 113.445 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 78.6 p -61.91 151.67 34.12 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 106.907 -1.516 . . . . 30.64 106.907 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.03 128.89 39.4 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 114.441 -1.254 . . . . 47.16 107.844 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.89 0.14 87.57 Favored Glycine 0 C--O 1.25 1.122 0 N-CA-C 117.296 1.679 . . . . 28.98 117.296 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.95 142.49 24.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.395 1.598 . . . . 26.56 112.166 -179.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.93 73.34 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.427 1.091 . . . . 21.12 110.912 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -64.18 -47.22 80.65 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.155 0.982 . . . . 27.65 111.157 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.31 -37.32 75.53 Favored 'Isoleucine or valine' 0 C--O 1.248 1.018 0 O-C-N 123.522 0.514 . . . . 19.86 110.314 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -65.91 -42.76 89.76 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.373 -0.831 . . . . 44.96 108.898 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.7 -41.36 95.91 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.292 -1.123 . . . . 14.95 110.292 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -71.81 -37.94 70.28 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-O 121.214 0.531 . . . . 19.03 110.654 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.52 -34.76 87.04 Favored Glycine 0 N--CA 1.469 0.861 0 CA-C-O 123.981 1.878 . . . . 14.33 110.51 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.64 -37.69 65.25 Favored 'General case' 0 C--O 1.26 1.656 0 CA-C-N 113.916 -1.142 . . . . 17.38 110.554 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -69.08 -42.05 76.72 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 125.308 1.63 . . . . 34.84 110.098 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.29 -47.59 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 N-CA-C 107.716 -1.216 . . . . 11.21 107.716 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.11 -36.99 78.67 Favored 'General case' 0 C--O 1.254 1.318 0 O-C-N 124.498 1.123 . . . . 12.06 113.684 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.31 -35.03 71.13 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 125.424 1.702 . . . . 10.54 110.15 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.45 97.83 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 120.99 -1.069 . . . . 11.87 108.93 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 mt -64.32 -40.02 95.07 Favored 'General case' 0 C--O 1.248 1.026 0 O-C-N 124.747 1.279 . . . . 15.32 110.019 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 98.8 m -60.29 -41.25 92.97 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 114.987 -1.006 . . . . 16.68 108.755 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -66.76 -34.4 77.75 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 123.23 1.49 . . . . 36.26 108.867 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.55 -49.94 71.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.952 -1.129 . . . . 14.86 107.952 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 31.1 t -55.95 -32.57 33.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 CA-C-O 121.875 0.845 . . . . 21.19 112.741 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.85 -17.48 57.33 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 116.428 2.01 . . . . 52.11 116.428 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -130.93 49.66 2.3 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 126.929 2.092 . . . . 32.07 110.039 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -21.89 61.72 Favored 'General case' 0 C--O 1.256 1.399 0 O-C-N 126.223 2.202 . . . . 27.02 111.393 -177.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.69 2.44 55.57 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.581 1.153 . . . . 28.74 111.904 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -152.16 56.0 0.83 Allowed 'General case' 0 C--N 1.315 -0.921 0 O-C-N 120.484 -1.385 . . . . 20.14 112.216 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . 0.46 ' N ' ' CD ' ' A' ' 77' ' ' PRO . 0.0 OUTLIER -57.07 -46.76 99.83 Favored Pre-proline 0 C--N 1.309 -1.155 0 O-C-N 126.085 2.115 . . . . 25.2 110.063 -179.09 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 76' ' ' LEU . 44.9 Cg_exo -59.77 -35.21 95.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.909 3.072 . . . . 20.44 114.06 -179.728 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.58 -44.43 8.55 Favored Glycine 0 C--O 1.246 0.872 0 N-CA-C 108.377 -1.889 . . . . 21.06 108.377 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.39 -32.47 73.29 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 113.235 0.828 . . . . 26.69 113.235 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.5 mt -113.02 22.94 13.88 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.231 -2.795 . . . . 25.2 115.166 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.1 p -60.68 -48.32 82.32 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.658 -2.592 . . . . 32.88 112.519 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.57 -44.83 85.58 Favored 'General case' 0 C--O 1.256 1.434 0 O-C-N 127.139 2.775 . . . . 58.54 110.383 -179.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.4 mt -67.45 -26.26 66.31 Favored 'General case' 0 C--O 1.248 1.016 0 CA-C-O 112.948 -3.406 . . . . 24.86 112.431 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -72.23 -41.58 66.7 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 127.384 2.927 . . . . 24.27 109.085 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -60.34 -50.69 72.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 111.014 -2.812 . . . . 33.51 107.505 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.11 -51.36 69.93 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 126.929 2.643 . . . . 17.49 111.729 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -64.82 -40.74 95.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 117.7 -1.6 . . . . 15.87 112.776 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.09 84.6 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 116.086 1.884 . . . . 17.96 116.086 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.74 -24.8 14.89 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 119.01 2.967 . . . . 35.42 119.01 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -113.5 -64.06 1.36 Allowed 'General case' 0 C--O 1.248 1.0 0 O-C-N 124.362 1.039 . . . . 44.42 113.236 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.0 mt -60.19 -49.55 77.18 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 125.183 1.393 . . . . 19.14 114.114 -177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 48.95 56.15 8.19 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 126.952 2.657 . . . . 29.61 113.831 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -82.15 124.24 38.98 Favored 'Isoleucine or valine' 0 C--O 1.25 1.125 0 CA-C-N 111.338 -2.665 . . . . 14.03 108.081 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -54.84 132.87 66.39 Favored Pre-proline 0 N--CA 1.48 1.058 0 O-C-N 124.894 1.371 . . . . 23.33 109.742 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -47.2 -29.55 9.38 Favored 'Trans proline' 0 C--O 1.262 1.695 0 C-N-CA 124.614 3.542 . . . . 18.21 118.528 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.8 m -62.5 -31.83 53.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 119.802 1.183 . . . . 23.94 111.821 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -63.0 -24.27 67.84 Favored 'General case' 0 C--O 1.247 0.968 0 CA-C-O 113.63 -3.081 . . . . 18.13 112.854 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -64.35 -38.53 91.35 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 128.614 3.696 . . . . 15.34 110.598 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -65.39 -36.99 85.64 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 125.731 1.895 . . . . 48.89 110.526 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 48.2 mt -65.71 -39.83 91.62 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 125.082 1.489 . . . . 12.62 112.424 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.06 -39.67 65.71 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 120.916 -1.115 . . . . 9.65 109.81 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.2 m -57.35 -50.5 72.75 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 109.533 -0.543 . . . . 11.72 109.533 179.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.59 -47.81 81.09 Favored 'General case' 0 C--O 1.262 1.737 0 O-C-N 125.693 1.871 . . . . 11.65 110.878 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 67.8 m -60.41 -36.51 78.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.306 1.042 . . . . 15.97 110.701 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 tp -70.19 -38.44 75.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 113.81 -1.541 . . . . 30.72 111.382 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -45.48 91.49 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 124.835 1.254 . . . . 13.89 108.209 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.54 -46.54 95.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 114.852 -1.067 . . . . 11.45 109.263 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.7 m -59.67 -52.18 66.61 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 123.682 0.614 . . . . 12.28 110.745 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.0 -47.62 80.41 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 124.423 1.077 . . . . 14.3 111.237 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.3 -43.95 83.65 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 117.402 -1.285 . . . . 18.46 110.993 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.0 p -70.11 -25.47 63.51 Favored 'General case' 0 C--O 1.246 0.894 0 O-C-N 124.807 1.317 . . . . 20.83 111.157 -176.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -93.58 -22.47 18.79 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 114.458 1.281 . . . . 21.39 114.458 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.05 63.05 65.26 Favored Pre-proline 0 C--O 1.249 1.072 0 CA-C-N 119.215 0.916 . . . . 25.32 110.477 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -53.88 -42.48 66.23 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 O-C-N 124.078 1.567 . . . . 19.15 115.945 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.5 m -74.26 -31.24 62.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 126.176 1.79 . . . . 31.04 112.722 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . 0.695 ' OD1' ' O ' ' A' ' 776' ' ' HOH . 3.6 m-20 -91.25 -18.94 23.57 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.777 1.399 . . . . 32.95 114.777 -178.249 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -80.97 66.41 6.48 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 125.617 2.627 . . . . 20.43 111.792 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.6 p -78.47 163.13 63.22 Favored Pre-proline 0 C--O 1.252 1.217 0 CA-C-N 113.376 -1.738 . . . . 12.75 108.4 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -47.71 -47.12 19.23 Favored 'Trans proline' 0 C--O 1.252 1.22 0 C-N-CA 121.853 1.702 . . . . 12.42 110.363 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.41 96.94 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 117.405 -1.284 . . . . 12.79 112.555 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.5 t -66.69 -40.16 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 123.962 1.839 . . . . 12.67 111.828 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -54.07 -53.83 47.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 124.133 1.92 . . . . 14.45 108.9 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.24 -42.63 86.77 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.527 -1.358 . . . . 14.22 111.486 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.4 m -69.14 -40.94 77.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 117.695 -1.145 . . . . 14.11 111.426 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 53.0 mt -66.68 -42.79 85.94 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 124.974 1.421 . . . . 11.8 109.886 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -56.86 -46.33 81.87 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 125.197 1.561 . . . . 19.72 107.461 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.79 -41.28 92.17 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 124.377 1.048 . . . . 19.88 111.827 179.826 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -59.65 -49.31 78.24 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 124.392 1.057 . . . . 10.13 109.064 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.46 -40.6 97.14 Favored 'General case' 0 C--O 1.252 1.237 0 C-N-CA 117.604 -1.639 . . . . 9.3 110.651 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.63 -41.31 90.17 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 119.7 -0.8 . . . . 12.39 108.846 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.76 -33.07 73.28 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 122.299 1.047 . . . . 34.47 110.717 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.62 -42.82 77.97 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 N-CA-C 107.364 -1.347 . . . . 11.96 107.364 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 39.9 m -57.2 -46.79 82.55 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 126.122 2.868 . . . . 15.34 114.269 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.6 m -59.21 -43.87 92.28 Favored 'General case' 0 C--O 1.257 1.476 0 C-N-CA 126.305 1.842 . . . . 14.89 111.366 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.5 t -64.7 -44.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 O-C-N 125.701 1.876 . . . . 12.85 110.372 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -31.87 72.56 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 127.087 2.155 . . . . 13.6 113.466 -178.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.1 p -105.74 13.08 30.21 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 112.576 0.584 . . . . 17.45 112.576 178.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.1 p -71.63 -16.66 62.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.475 2.398 . . . . 18.36 117.475 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -106.32 7.22 31.18 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 127.006 2.122 . . . . 33.62 111.997 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.17 -37.54 77.61 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 125.624 1.828 . . . . 21.12 114.856 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . 0.424 ' NH1' ' OD1' ' C' ' 126' ' ' ASP . 33.4 ptt180 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 116.152 -1.88 . . . . 27.6 111.846 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.238 0.479 0 CA-C-O 121.241 0.543 . . . . 61.28 111.599 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.82 171.11 9.77 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 129.362 3.065 . . . . 50.43 110.991 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -81.31 167.7 19.23 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.007 -1.906 . . . . 39.72 109.259 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.22 -31.52 72.07 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 115.384 -0.825 . . . . 32.11 113.053 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.54 -36.28 52.42 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.751 1.221 . . . . 41.25 111.771 177.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -70.16 -43.46 70.81 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.996 1.435 . . . . 34.58 107.24 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -44.28 91.49 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 124.232 1.967 . . . . 49.67 108.271 179.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.81 99.37 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 114.365 -1.288 . . . . 23.15 110.236 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.0 75.1 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 125.691 1.596 . . . . 19.66 114.39 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -65.08 -44.77 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 114.611 -1.177 . . . . 18.25 108.604 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -56.46 -51.93 66.58 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 122.958 1.361 . . . . 26.29 111.526 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.06 97.91 Favored 'General case' 0 C--O 1.25 1.121 0 CA-C-N 111.403 -2.635 . . . . 25.49 111.542 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.55 -45.96 81.34 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 120.737 0.303 . . . . 29.66 110.476 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -56.16 -35.44 67.2 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 115.855 -0.611 . . . . 24.77 111.932 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.19 -12.87 18.38 Favored Glycine 0 N--CA 1.469 0.871 0 CA-C-O 119.232 -0.76 . . . . 30.14 112.937 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -97.08 -9.61 27.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 126.434 1.894 . . . . 49.77 113.441 179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -76.66 130.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 O-C-N 124.406 1.066 . . . . 30.84 113.495 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mtpp -91.8 89.98 7.3 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 103.289 -2.856 . . . . 42.47 103.289 176.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 3.4 t -55.8 -40.14 59.91 Favored 'Isoleucine or valine' 0 C--O 1.263 1.789 0 N-CA-C 117.064 2.246 . . . . 30.89 117.064 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.58 -41.56 88.34 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 120.249 1.386 . . . . 47.35 110.696 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -66.35 -54.25 26.81 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.228 2.205 . . . . 47.39 115.205 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.68 -37.1 79.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 113.05 -1.887 . . . . 22.89 108.971 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -60.25 -57.1 20.9 Favored Glycine 0 C--O 1.255 1.438 0 C-N-CA 126.061 1.791 . . . . 18.03 112.013 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.68 -41.26 99.57 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 108.483 -1.847 . . . . 17.19 108.483 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.37 -50.94 69.56 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 116.99 -1.481 . . . . 21.82 111.04 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.05 -54.38 47.77 Favored 'General case' 0 C--O 1.253 1.242 0 O-C-N 126.354 2.284 . . . . 15.18 110.105 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.05 -45.88 89.64 Favored 'General case' 0 C--O 1.253 1.258 0 O-C-N 124.505 1.128 . . . . 13.96 112.099 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -58.58 -50.12 70.27 Favored Glycine 0 C--O 1.254 1.349 0 N-CA-C 108.888 -1.685 . . . . 14.25 108.888 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 54.6 mtt-85 -61.28 -37.1 81.97 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 117.882 0.841 . . . . 13.26 112.033 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 12.7 tp -57.45 -47.41 81.91 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.357 1.661 . . . . 12.41 110.086 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -24.57 65.76 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.13 1.159 . . . . 18.59 114.13 -178.558 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 55.3 t -87.26 -48.06 15.56 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 CA-C-O 117.097 -1.43 . . . . 15.7 111.462 -178.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 57.3 t -74.64 -32.74 29.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 CA-C-O 114.525 -2.655 . . . . 15.56 113.646 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -126.76 74.94 75.58 Favored Pre-proline 0 C--N 1.304 -1.406 0 C-N-CA 127.781 2.432 . . . . 25.29 106.155 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -55.62 -26.22 54.29 Favored 'Trans proline' 0 C--O 1.253 1.272 0 N-CA-C 116.5 1.692 . . . . 18.5 116.5 -175.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 46.7 p90 -62.36 -18.83 62.51 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-N 121.322 1.874 . . . . 18.93 110.692 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 57.9 p -70.65 -14.62 62.54 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 120.007 1.276 . . . . 17.21 111.495 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.43 -22.85 65.4 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-N 112.491 -2.141 . . . . 21.73 111.266 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -50.65 -30.38 13.37 Favored 'General case' 0 C--O 1.253 1.287 0 O-C-N 124.937 1.398 . . . . 27.28 113.258 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.08 -9.07 52.53 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 116.256 -1.83 . . . . 20.41 115.4 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -122.27 30.39 6.58 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 125.34 1.65 . . . . 25.3 114.231 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.65 -34.54 65.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 122.281 1.038 . . . . 51.02 111.743 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 92.9 p -70.2 -19.09 63.19 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-N 114.668 -1.151 . . . . 33.89 112.634 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -65.5 -16.41 63.63 Favored 'General case' 0 C--O 1.25 1.128 0 CA-C-O 117.053 -1.451 . . . . 31.37 111.445 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 112.65 -147.39 18.37 Favored Glycine 0 N--CA 1.477 1.375 0 C-N-CA 118.206 -1.949 . . . . 33.17 110.08 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -73.09 118.2 15.75 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.744 -1.228 . . . . 47.5 113.748 -178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 67.5 mt -129.09 19.46 5.94 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 125.958 2.037 . . . . 36.36 111.384 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 73.1 p -65.71 -31.83 73.05 Favored 'General case' 0 C--O 1.259 1.6 0 N-CA-C 118.508 2.781 . . . . 45.24 118.508 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 19.4 p -129.23 162.02 28.82 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.818 -0.808 . . . . 36.89 108.818 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.99 -49.34 63.5 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.137 0.575 . . . . 30.89 110.102 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.45 -46.77 83.24 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 125.622 1.826 . . . . 50.17 112.981 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.67 -43.74 80.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 123.974 1.845 . . . . 28.49 110.563 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.75 -53.0 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.598 -1.183 . . . . 26.06 110.809 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' MET . . . . . . . . . . . . . 87.3 mmm -64.1 -35.05 79.48 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-O 116.864 -1.541 . . . . 26.98 111.696 -176.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -90.31 -4.6 57.02 Favored 'General case' 0 C--O 1.251 1.157 0 O-C-N 124.422 1.076 . . . . 35.48 113.057 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -64.35 119.09 53.36 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 123.662 0.601 . . . . 25.23 110.927 -178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -61.17 -33.11 91.23 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.71 2.273 . . . . 24.09 114.845 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -77.65 -31.83 52.93 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 124.749 1.281 . . . . 47.09 110.586 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 3.2 t -65.84 -39.52 84.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 125.09 2.376 . . . . 24.96 107.345 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -55.95 27.61 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 112.51 -2.132 . . . . 51.99 111.985 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.41 -47.45 86.05 Favored 'General case' 0 C--O 1.256 1.405 0 CA-C-N 114.758 -1.11 . . . . 20.04 110.856 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 39.5 t60 -63.01 -41.68 99.63 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 113.975 -1.466 . . . . 19.0 111.406 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -43.47 93.84 Favored Glycine 0 N--CA 1.471 1.001 0 N-CA-C 109.462 -1.455 . . . . 15.55 109.462 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 49.7 tttp -58.62 -48.13 82.05 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 124.227 1.011 . . . . 35.98 110.76 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -57.45 -50.39 73.18 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-N 113.128 -1.851 . . . . 26.68 112.508 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.9 -45.38 98.35 Favored 'Isoleucine or valine' 0 C--O 1.255 1.365 0 CA-C-N 115.553 -0.749 . . . . 17.22 111.0 -178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 1.7 tp -71.4 -31.12 66.9 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 125.382 1.676 . . . . 19.04 113.265 -179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -64.54 -37.9 89.17 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 106.501 -1.666 . . . . 34.32 106.501 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -68.1 -43.65 78.0 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 126.066 2.104 . . . . 16.92 107.991 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -58.54 -45.1 89.6 Favored 'General case' 0 C--O 1.261 1.66 0 O-C-N 124.883 1.365 . . . . 18.95 110.019 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 57.5 m -55.0 -34.42 63.4 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 123.288 1.518 . . . . 22.47 113.148 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.65 -38.47 90.42 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 113.078 -1.874 . . . . 39.77 108.022 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.77 -34.73 83.75 Favored Glycine 0 N--CA 1.478 1.482 0 CA-C-N 113.39 -1.732 . . . . 23.79 110.117 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 92.8 mmm -60.05 -21.65 61.68 Favored 'General case' 0 C--O 1.247 0.937 0 O-C-N 126.437 1.904 . . . . 27.59 110.337 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.36 -11.33 46.52 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 125.42 1.7 . . . . 46.13 109.041 179.074 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -130.92 40.33 3.49 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 120.807 1.639 . . . . 39.9 115.033 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 14.8 mt -48.2 -18.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.609 1.337 . . . . 33.38 114.609 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -89.39 -31.45 17.75 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 115.271 -2.3 . . . . 49.01 111.276 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -130.43 68.31 1.47 Allowed 'General case' 0 C--O 1.247 0.969 0 O-C-N 126.013 2.071 . . . . 36.03 109.81 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 61.6 mt -67.72 -39.13 84.35 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 125.876 1.985 . . . . 25.72 109.948 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -56.42 -51.73 67.3 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.546 1.138 . . . . 48.3 111.389 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.29 -43.74 96.51 Favored Glycine 0 N--CA 1.473 1.104 0 O-C-N 126.483 2.365 . . . . 21.96 108.461 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 28.2 m -56.16 -45.6 79.63 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 116.381 -1.771 . . . . 21.35 114.389 -178.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -101.19 11.62 39.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 126.653 2.471 . . . . 24.19 114.656 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.33 -48.69 71.09 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 113.078 0.77 . . . . 19.25 113.078 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.55 91.15 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.275 0.984 . . . . 19.74 111.138 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.63 -28.45 62.76 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 116.729 -1.605 . . . . 19.2 111.814 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 28.4 t -65.34 -48.97 71.16 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 125.527 2.584 . . . . 17.82 107.42 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.64 -46.69 70.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 110.744 -2.935 . . . . 49.77 110.119 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.15 -46.24 81.7 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.163 0.915 . . . . 23.35 112.869 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -61.93 -32.27 72.67 Favored 'General case' 0 C--O 1.253 1.289 0 CA-C-O 122.877 1.323 . . . . 15.02 112.11 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.93 -63.7 1.35 Allowed 'General case' 0 C--O 1.257 1.48 0 CA-C-N 114.978 -1.01 . . . . 16.68 113.222 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -67.94 -45.37 74.47 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 113.699 -3.048 . . . . 33.51 114.725 -176.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.22 -46.18 6.87 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 127.42 2.95 . . . . 40.21 114.56 179.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 mt -90.31 -16.35 29.43 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 114.116 -2.849 . . . . 21.5 114.494 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 35.1 m-70 52.48 45.31 28.79 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 123.488 2.858 . . . . 26.22 114.569 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -92.04 120.23 40.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 113.958 -1.474 . . . . 15.05 109.554 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -64.29 128.44 93.23 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 105.471 -2.048 . . . . 14.99 105.471 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -62.37 -14.42 38.74 Favored 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 124.088 3.192 . . . . 12.21 114.392 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -58.06 -33.85 69.47 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.132 -1.062 . . . . 30.23 108.132 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -59.0 -36.18 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.474 3.11 . . . . 19.01 110.929 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -65.16 -35.16 80.23 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-O 116.776 -1.583 . . . . 20.04 109.381 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -71.94 -41.68 67.53 Favored 'General case' 0 C--O 1.253 1.285 0 O-C-N 125.393 1.683 . . . . 35.71 111.175 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 24.2 mt -58.96 -51.31 70.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.507 -1.224 . . . . 19.12 107.852 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.16 -37.34 84.86 Favored 'General case' 0 C--O 1.255 1.39 0 O-C-N 124.125 0.891 . . . . 12.19 111.53 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.63 99.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 118.888 -1.625 . . . . 14.88 109.862 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -69.94 -37.84 75.98 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.452 -1.261 . . . . 29.14 111.679 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 17.8 t -67.67 -36.05 74.79 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 O-C-N 125.585 1.803 . . . . 13.53 110.072 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 58.1 tp -59.47 -44.21 93.06 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 113.405 -1.725 . . . . 10.87 108.884 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.74 -42.88 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 124.862 1.351 . . . . 14.56 111.7 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.35 -41.17 90.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 122.781 0.432 . . . . 13.16 110.182 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 t -62.67 -43.27 98.45 Favored 'Isoleucine or valine' 0 C--O 1.246 0.875 0 O-C-N 120.919 -1.113 . . . . 9.98 112.798 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.44 -41.07 96.62 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.539 1.161 . . . . 15.65 108.732 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.12 85.64 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.374 -1.285 . . . . 14.93 107.59 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -63.65 -46.2 86.74 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 119.772 -1.83 . . . . 18.75 110.928 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.86 -32.31 69.27 Favored 'General case' 0 C--O 1.257 1.459 0 CA-C-O 115.295 -2.288 . . . . 23.2 115.907 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -108.7 0.06 20.34 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.045 1.498 . . . . 31.95 115.045 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 49.84 -128.01 24.64 Favored Glycine 0 C--N 1.302 -1.337 0 O-C-N 125.263 1.602 . . . . 23.94 111.949 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -26.26 68.01 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 127.435 2.491 . . . . 51.71 113.793 -177.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -63.37 -29.11 70.47 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 122.939 1.352 . . . . 50.21 110.596 178.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -86.88 81.11 8.25 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 126.512 3.053 . . . . 24.08 105.62 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 43.6 p -72.18 160.66 82.13 Favored Pre-proline 0 C--O 1.25 1.081 0 CA-C-N 113.159 -1.837 . . . . 21.31 111.405 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.92 -36.85 92.96 Favored 'Trans proline' 0 C--O 1.257 1.426 0 CA-C-N 112.081 -1.792 . . . . 19.5 110.017 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 26.2 t -69.74 -42.64 80.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.86 0 CA-C-O 121.837 0.827 . . . . 21.25 111.545 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . 4.3 tp -63.35 -45.64 90.27 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 112.514 -2.13 . . . . 29.61 106.973 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -57.98 -43.39 86.48 Favored 'General case' 0 C--O 1.256 1.441 0 O-C-N 121.648 -0.657 . . . . 16.51 110.643 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.25 -44.68 84.11 Favored 'General case' 0 C--O 1.246 0.895 0 O-C-N 125.14 1.525 . . . . 17.92 110.174 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -59.97 -43.6 94.96 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-O 115.829 -2.034 . . . . 26.15 112.09 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -69.35 -32.61 71.78 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 127.916 3.26 . . . . 20.35 113.517 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -60.56 -42.52 96.77 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 107.941 -1.133 . . . . 20.31 107.941 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mttt -65.71 -38.19 88.51 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.09 -0.959 . . . . 37.07 108.723 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.92 -52.61 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 124.565 1.165 . . . . 17.82 112.502 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 3.6 m -60.24 -35.57 62.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 O-C-N 123.922 0.764 . . . . 12.87 108.969 -178.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.6 -41.34 84.21 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.724 -0.843 . . . . 15.5 108.724 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.19 -45.5 95.9 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 108.249 -1.94 . . . . 15.63 108.249 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . . 59.2 t -64.86 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 C-N-CA 119.689 -0.804 . . . . 16.23 112.456 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.48 88.3 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.771 0.828 . . . . 19.53 110.577 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.72 -37.69 82.58 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 124.498 1.124 . . . . 47.84 111.417 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.01 76.07 Favored 'General case' 0 C--O 1.248 1.017 0 O-C-N 124.939 1.4 . . . . 19.97 107.249 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.11 -23.19 65.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.479 1.659 . . . . 19.62 115.479 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.94 -20.14 26.31 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 127.317 2.247 . . . . 18.87 113.25 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -53.35 -45.51 69.17 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 117.963 2.579 . . . . 49.07 117.963 -175.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -88.22 15.26 7.83 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 123.69 2.95 . . . . 60.15 114.191 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -75.14 147.07 40.82 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 107.76 -1.2 . . . . 24.22 107.76 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.264 1.824 0 O-C-N 126.644 2.465 . . . . 31.83 112.216 -178.026 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.242 0.669 0 CA-C-O 125.039 2.352 . . . . 47.53 110.009 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 29.5 mt -78.29 121.59 24.63 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 110.485 -3.052 . . . . 38.65 108.867 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 87.1 p -78.71 175.69 10.2 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 107.059 -1.46 . . . . 33.96 107.059 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.69 -43.09 94.2 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 126.79 2.556 . . . . 27.69 108.882 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.16 -34.17 76.98 Favored 'General case' 0 C--O 1.254 1.308 0 CA-C-N 113.156 -1.838 . . . . 24.81 111.691 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -63.63 -46.74 84.32 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 125.981 2.051 . . . . 22.28 110.671 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.93 -46.56 87.67 Favored 'General case' 0 C--O 1.259 1.6 1 O-C-N 129.662 4.351 . . . . 30.16 111.047 -178.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.28 82.81 Favored Glycine 0 C--O 1.248 1.018 0 CA-C-N 113.465 -1.698 . . . . 23.51 110.191 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -61.58 -41.34 97.27 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 113.011 0.745 . . . . 27.29 113.011 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 t -64.99 -49.4 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 125.927 2.017 . . . . 21.67 109.601 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -60.27 -46.8 88.54 Favored 'General case' 0 C--O 1.25 1.119 0 O-C-N 126.654 2.471 . . . . 32.63 109.952 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.06 -50.1 74.69 Favored 'General case' 0 C--O 1.258 1.542 0 C-N-CA 119.274 -0.97 . . . . 24.89 111.838 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.57 -36.14 83.25 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.072 1.138 . . . . 22.11 114.072 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -69.53 -32.73 71.73 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 122.95 1.357 . . . . 29.08 108.563 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.67 -48.6 83.98 Favored Glycine 0 CA--C 1.548 2.1 0 CA-C-N 113.045 -1.889 . . . . 32.43 108.523 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -66.96 -32.69 74.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 117.232 -1.366 . . . . 54.04 109.771 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 t -57.3 -47.93 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 105.919 -1.882 . . . . 29.73 105.919 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 52.84 -131.19 40.4 Favored Glycine 0 C--O 1.251 1.194 0 O-C-N 126.095 2.122 . . . . 32.78 110.867 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.17 -14.45 59.34 Favored Glycine 0 C--O 1.254 1.4 0 N-CA-C 118.158 2.023 . . . . 32.35 118.158 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.45 1.34 33.65 Favored 'General case' 0 C--O 1.257 1.472 0 N-CA-C 114.689 1.366 . . . . 36.73 114.689 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.91 -50.17 61.62 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 126.209 2.193 . . . . 25.04 111.833 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.07 82.0 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 122.489 1.138 . . . . 20.05 111.112 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -61.18 -48.03 83.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 112.943 -1.935 . . . . 52.03 112.706 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -64.47 -36.14 83.22 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.735 0.814 . . . . 25.84 112.291 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.9 -46.55 91.32 Favored Glycine 0 C--O 1.255 1.456 0 N-CA-C 107.351 -2.299 . . . . 18.73 107.351 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.38 84.15 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 118.818 -1.153 . . . . 18.84 110.843 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -69.84 -37.74 76.28 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.468 0.307 . . . . 30.33 110.57 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.07 -48.02 83.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.649 -1.612 . . . . 15.74 106.649 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 37.9 mt -54.24 -50.11 67.95 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 125.354 1.658 . . . . 22.0 114.117 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.83 -44.33 94.11 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 113.46 -1.7 . . . . 46.45 112.096 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 67.4 mtt-85 -62.06 -44.86 95.77 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 125.738 1.899 . . . . 24.16 108.437 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.65 -46.9 80.77 Favored 'General case' 0 C--O 1.264 1.822 0 C-N-CA 127.284 2.234 . . . . 17.23 111.527 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -65.86 -34.9 79.2 Favored 'General case' 0 C--O 1.258 1.537 0 CA-C-O 116.402 -1.761 . . . . 22.61 115.369 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 34.2 mt -77.89 -44.76 26.12 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.039 1.462 . . . . 27.62 112.833 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 1.5 m -68.38 -47.73 66.58 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 126.588 2.43 . . . . 19.88 113.081 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -122.09 77.14 41.7 Favored Pre-proline 0 C--O 1.253 1.244 0 C-N-CA 124.24 1.016 . . . . 18.91 111.662 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -50.29 -27.39 17.77 Favored 'Trans proline' 0 C--O 1.253 1.228 0 C-N-CA 123.783 2.989 . . . . 18.69 116.126 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 60.4 p -62.67 -23.78 67.29 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 124.274 1.03 . . . . 17.3 112.081 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 79.1 p -68.33 -18.53 64.52 Favored 'General case' 0 C--O 1.247 0.922 0 O-C-N 124.06 0.85 . . . . 12.96 110.699 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -72.5 -17.76 61.72 Favored 'General case' 0 C--O 1.251 1.143 0 O-C-N 124.918 1.386 . . . . 19.03 112.003 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 28.6 p -61.93 -18.46 60.39 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 116.716 -1.611 . . . . 15.3 111.351 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -89.49 -6.84 56.07 Favored 'General case' 0 C--O 1.255 1.382 0 N-CA-C 114.287 1.217 . . . . 17.31 114.287 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -125.97 49.01 3.27 Favored Pre-proline 0 N--CA 1.486 1.359 0 N-CA-C 113.249 0.833 . . . . 22.19 113.249 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -61.13 -30.77 89.58 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 C-N-CA 123.508 2.805 . . . . 26.93 114.632 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' HIS . . . . . 0.628 ' N ' ' ND1' ' C' ' 45' ' ' HIS . 14.0 p-80 -93.95 17.77 11.69 Favored 'General case' 0 C--O 1.255 1.392 0 O-C-N 120.78 -1.2 . . . . 37.47 111.681 -179.658 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -108.72 156.07 20.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.626 -1.25 . . . . 26.49 107.626 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.64 109.45 21.08 Favored 'General case' 0 C--O 1.247 0.959 1 N-CA-C 98.749 -4.537 . . . . 40.64 98.749 173.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.14 16.02 24.1 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 125.373 1.67 . . . . 32.77 113.873 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 70.9 p -67.33 163.43 20.66 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.27 1.606 . . . . 38.35 109.238 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 17.3 t-80 -61.93 131.84 51.04 Favored 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.942 1.401 . . . . 42.69 107.364 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.6 11.36 77.03 Favored Glycine 0 C--O 1.258 1.64 0 N-CA-C 119.434 2.533 . . . . 33.22 119.434 179.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.8 142.4 35.01 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 125.041 1.083 . . . . 30.06 108.511 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.91 -40.52 93.44 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 125.642 1.577 . . . . 26.12 110.813 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.05 -48.19 80.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 112.854 -1.976 . . . . 28.57 110.579 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.6 t -66.22 -46.01 88.52 Favored 'Isoleucine or valine' 0 C--O 1.248 1.019 0 O-C-N 125.592 1.808 . . . . 23.6 108.823 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -62.48 -38.02 88.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 117.844 -1.542 . . . . 54.59 111.107 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.86 -46.88 90.57 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 110.701 -0.96 . . . . 19.87 110.701 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -66.97 -42.65 84.8 Favored 'General case' 0 C--O 1.256 1.398 0 O-C-N 126.282 1.813 . . . . 22.75 112.206 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.93 -37.13 76.77 Favored Glycine 0 C--O 1.27 2.385 0 O-C-N 119.161 -2.212 . . . . 18.34 111.459 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.88 76.57 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-O 118.233 -0.889 . . . . 16.2 110.429 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.3 mttp -71.7 -37.62 70.65 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.827 1.329 . . . . 33.11 111.446 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.09 -52.18 62.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 113.968 -1.469 . . . . 11.1 109.213 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.57 88.32 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 111.362 -2.654 . . . . 12.24 110.877 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.59 83.65 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.769 -0.826 . . . . 11.45 108.769 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.2 86.52 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 118.524 -1.27 . . . . 13.48 110.746 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 mt -60.62 -38.93 86.38 Favored 'General case' 0 C--O 1.256 1.447 0 CA-C-N 115.361 -0.836 . . . . 17.84 110.202 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -62.15 -41.45 98.31 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.071 -0.968 . . . . 20.22 109.283 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.89 -48.76 79.04 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.612 1.195 . . . . 46.47 109.71 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.68 -47.15 70.72 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.33 1.452 . . . . 24.29 111.836 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 97.7 t -60.51 -31.58 49.2 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 C-N-CA 125.32 1.448 . . . . 24.86 112.15 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . 0.257 25.4 mt-10 -79.0 -25.93 43.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 118.18 -0.914 . . . . 57.18 109.111 179.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -119.66 52.69 1.09 Allowed 'General case' 0 C--N 1.317 -0.819 0 O-C-N 124.548 1.155 . . . . 43.48 110.772 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 mt -61.31 -31.54 71.39 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 124.882 1.364 . . . . 30.0 110.398 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -80.23 10.24 4.72 Favored 'General case' 0 C--O 1.252 1.225 0 O-C-N 125.133 1.521 . . . . 46.91 112.903 -178.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -167.03 60.23 0.08 Allowed 'General case' 0 C--O 1.25 1.098 0 CA-C-N 118.68 0.673 . . . . 35.67 111.462 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' LEU . . . . . 0.631 ' N ' ' CD ' ' C' ' 77' ' ' PRO . 0.0 OUTLIER -56.87 -40.23 83.56 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 113.896 -1.502 . . . . 26.72 111.756 -179.309 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' C' ' 76' ' ' LEU . 44.1 Cg_exo -59.4 -39.55 75.6 Favored 'Trans proline' 0 C--O 1.254 1.286 0 C-N-CA 122.473 2.115 . . . . 25.66 113.427 -178.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.86 -42.25 13.21 Favored Glycine 0 N--CA 1.484 1.887 0 CA-C-O 124.635 2.242 . . . . 23.75 109.64 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.88 -35.72 73.46 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 113.387 -1.407 . . . . 25.26 111.194 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 77.7 mt -109.31 14.27 23.82 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-O 114.785 -2.531 . . . . 23.48 116.192 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 13.8 p -50.46 -53.86 26.46 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-O 115.595 -2.145 . . . . 32.25 112.626 -177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -66.86 -31.79 72.62 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-O 115.48 -2.2 . . . . 49.08 115.337 -179.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.63 -23.52 61.71 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 115.525 -2.178 . . . . 18.86 108.363 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' SER . . . . . . . . . . . . . 3.2 m -66.93 -49.39 65.65 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.255 2.222 . . . . 20.15 109.088 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -64.62 -41.92 95.85 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 126.572 2.42 . . . . 34.49 108.65 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 20.4 tp -64.18 -43.47 95.02 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 113.451 0.908 . . . . 21.55 113.451 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -69.71 -43.79 71.7 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 117.197 -1.801 . . . . 18.65 109.569 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.55 -47.61 75.28 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 116.194 1.924 . . . . 16.04 116.194 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -95.27 -25.85 16.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 113.682 -3.056 . . . . 35.91 117.45 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 69.2 tttt -113.63 -60.47 1.88 Allowed 'General case' 0 C--N 1.317 -0.825 0 O-C-N 128.477 3.611 . . . . 39.37 115.055 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 59.4 mt -67.83 -45.71 73.89 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 119.787 1.176 . . . . 18.47 112.518 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' ARG . . . . . . . . . . . . . 3.0 mpp_? 51.17 55.27 9.77 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 125.245 1.418 . . . . 31.55 113.065 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 53.2 t -79.49 127.85 38.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 O-C-N 126.08 2.113 . . . . 14.54 105.744 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.82 133.63 92.12 Favored Pre-proline 0 C--N 1.311 -1.091 0 N-CA-C 108.336 -0.987 . . . . 19.35 108.336 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -44.62 -38.53 12.42 Favored 'Trans proline' 0 C--O 1.263 1.737 0 C-N-CA 123.543 2.828 . . . . 19.97 117.123 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 20.8 m -54.52 -32.28 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 122.538 2.426 . . . . 24.49 112.987 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -59.49 -29.48 67.87 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 127.337 2.898 . . . . 16.14 112.848 -177.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -63.34 -37.93 89.18 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 125.067 1.479 . . . . 18.05 109.704 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -62.61 -38.97 92.27 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.928 0.767 . . . . 47.64 109.967 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 50.8 mt -68.55 -41.71 79.41 Favored 'General case' 0 C--O 1.25 1.122 0 CA-C-O 116.966 -1.492 . . . . 14.73 111.906 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.55 -39.09 84.96 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 117.472 -1.691 . . . . 18.53 110.115 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m -54.52 -53.35 55.57 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 126.114 1.766 . . . . 18.46 112.027 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -56.65 -52.96 62.89 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 126.393 1.877 . . . . 18.43 107.996 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' SER . . . . . . . . . . . . . 31.4 m -51.92 -40.31 60.55 Favored 'General case' 0 C--O 1.252 1.202 0 O-C-N 124.847 1.342 . . . . 18.17 112.198 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 16.5 tp -70.5 -43.15 70.27 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 117.142 -1.409 . . . . 27.34 110.458 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.16 -44.08 92.12 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 125.727 1.892 . . . . 18.45 111.275 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 27.7 t -59.93 -35.72 62.48 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.22 0 C-N-CA 125.024 1.33 . . . . 18.65 109.707 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' THR . . . . . . . . . . . . . 87.9 m -70.14 -49.4 50.99 Favored 'General case' 0 C--O 1.246 0.914 0 O-C-N 125.795 1.934 . . . . 18.37 108.965 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 mt -60.05 -44.39 94.72 Favored 'General case' 0 C--N 1.311 -1.074 0 O-C-N 127.222 2.826 . . . . 21.54 110.374 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.19 -47.52 78.19 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 124.954 1.301 . . . . 18.63 113.569 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 2.7 p -69.33 -25.11 64.04 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 114.359 -1.291 . . . . 28.39 113.906 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -98.92 -23.89 15.16 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 114.173 -2.822 . . . . 27.04 112.684 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' LEU . . . . . . . . . . . . . 5.5 mp -129.31 62.22 61.59 Favored Pre-proline 0 C--O 1.254 1.313 0 CA-C-N 121.411 1.914 . . . . 34.15 111.028 -178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -54.15 -35.01 80.96 Favored 'Trans proline' 0 C--O 1.252 1.198 0 O-C-N 123.85 1.447 . . . . 28.69 114.656 -176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' SER . . . . . . . . . . . . . 33.7 m -85.8 -25.52 26.29 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 115.687 -2.101 . . . . 32.4 111.32 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -93.21 -17.24 23.93 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 114.19 -3.004 . . . . 35.45 112.531 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -82.1 61.49 5.39 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 127.72 3.138 . . . . 25.16 113.149 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' THR . . . . . . . . . . . . . 17.3 p -71.08 162.11 74.36 Favored Pre-proline 0 C--O 1.246 0.916 0 CA-C-N 114.308 -1.314 . . . . 22.04 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -53.46 -45.74 38.83 Favored 'Trans proline' 0 C--O 1.261 1.629 0 C-N-CA 120.838 1.025 . . . . 22.0 110.012 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.63 -32.96 74.82 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 117.652 -1.166 . . . . 19.26 112.983 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 t -73.48 -38.12 52.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 124.582 1.176 . . . . 22.61 109.453 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -54.08 -52.57 60.54 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-N 112.816 -1.993 . . . . 17.69 108.721 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.56 96.11 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 125.713 1.605 . . . . 14.66 113.317 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' SER . . . . . . . . . . . . . 68.0 m -72.0 -34.45 68.89 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 112.392 0.515 . . . . 19.14 112.392 178.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.72 -46.37 66.1 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 125.591 1.556 . . . . 16.72 108.341 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' NH1' ' A' ' 141' ' ' ARG . 17.6 t70 -56.89 -45.76 82.34 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 114.321 -1.309 . . . . 24.78 107.995 179.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -65.61 -40.38 92.58 Favored 'General case' 0 C--O 1.262 1.76 0 O-C-N 119.548 -1.97 . . . . 18.64 111.828 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.36 -49.02 75.52 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.061 -0.972 . . . . 14.66 109.766 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -39.0 89.6 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.874 -1.057 . . . . 17.6 109.537 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.15 99.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.378 1.561 . . . . 20.53 109.11 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -43.97 97.26 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.49 -1.232 . . . . 33.36 110.258 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 t -61.09 -44.82 99.06 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 C-N-CA 124.232 1.013 . . . . 15.88 108.739 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 53.7 m -60.07 -41.69 92.95 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.936 -1.029 . . . . 20.51 113.288 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' THR . . . . . . . . . . . . . 52.1 m -64.55 -42.78 95.46 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 113.886 -1.506 . . . . 17.29 111.993 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' VAL . . . . . . . . . . . . . 69.0 t -66.73 -44.02 89.71 Favored 'Isoleucine or valine' 0 C--O 1.252 1.227 0 O-C-N 126.408 2.318 . . . . 18.7 109.428 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' LEU . . . . . . . . . . . . . 14.6 mt -64.06 -26.4 68.54 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 120.154 1.343 . . . . 16.9 112.851 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' THR . . . . . . . . . . . . . 44.7 p -105.66 7.51 32.7 Favored 'General case' 0 C--O 1.247 0.949 0 C-N-CA 118.286 -1.365 . . . . 19.8 113.059 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' SER . . . . . . . . . . . . . 79.8 p -65.95 -19.86 66.01 Favored 'General case' 0 C--O 1.255 1.377 0 N-CA-C 115.948 1.833 . . . . 23.05 115.948 -177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -108.46 18.19 21.24 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 120.484 1.493 . . . . 30.92 112.432 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -65.38 -28.96 69.64 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 126.841 2.588 . . . . 19.98 114.075 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' ARG . . . . . . . . . . . . . 30.2 ptt180 . . . . . 0 C--O 1.26 1.643 0 CA-C-O 117.821 -1.085 . . . . 24.08 110.731 179.924 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' MET . . . . . . . . . . . . . 34.7 mtp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 119.356 -0.354 . . . . 61.45 111.811 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 83.4 mt -87.24 147.86 25.38 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 125.757 1.911 . . . . 53.11 108.879 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' THR . . . . . . . . . . . . . 58.7 p -83.62 162.46 20.79 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-N 112.614 -2.084 . . . . 50.79 108.674 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.71 -37.85 52.67 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 125.52 1.762 . . . . 50.39 109.349 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.06 -41.46 77.56 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 116.01 1.856 . . . . 63.09 116.01 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -66.72 -40.71 88.51 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 113.496 -1.684 . . . . 47.82 110.566 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -60.23 -51.16 70.74 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-O 123.634 1.683 . . . . 59.4 108.124 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.97 -48.22 82.32 Favored 'General case' 0 C--O 1.25 1.124 0 CA-C-N 114.319 -1.31 . . . . 33.94 109.176 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.97 81.21 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 115.52 1.674 . . . . 25.27 115.52 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.4 -38.79 27.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.9 0 C-N-CA 124.366 1.066 . . . . 26.72 111.166 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' THR . . . . . . . . . . . . . 24.5 m -64.65 -44.49 90.27 Favored 'General case' 0 C--O 1.249 1.041 0 CA-C-N 114.412 -1.267 . . . . 32.78 111.641 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.75 94.22 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-N 112.606 -2.088 . . . . 29.11 110.437 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -72.32 -38.05 68.77 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 125.37 1.669 . . . . 25.64 112.777 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -56.86 -35.06 68.43 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 114.533 -1.212 . . . . 28.98 111.191 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.74 16.66 0.14 Allowed Glycine 0 C--O 1.247 0.936 0 CA-C-O 117.646 -1.641 . . . . 35.04 114.424 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -126.79 -9.89 6.1 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 122.975 3.387 . . . . 40.23 109.911 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 11.9 t -80.11 133.11 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 127.888 3.242 . . . . 27.87 110.607 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.38 75.64 7.64 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 111.475 -2.602 . . . . 47.6 105.374 176.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -36.06 -48.48 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 128.969 2.908 . . . . 36.2 116.1 -178.762 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.56 -55.13 34.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 122.346 1.07 . . . . 50.26 111.317 -178.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.74 -49.42 76.63 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 114.369 1.248 . . . . 56.84 114.369 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.61 -43.04 96.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 126.708 2.003 . . . . 30.43 110.4 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.71 -49.19 81.21 Favored Glycine 0 C--O 1.249 1.04 0 C-N-CA 126.389 1.947 . . . . 24.07 111.207 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.11 91.45 Favored Glycine 0 N--CA 1.47 0.907 0 CA-C-O 123.58 1.656 . . . . 19.24 112.337 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.83 -49.57 61.48 Favored 'General case' 0 C--O 1.257 1.489 0 CA-C-N 113.585 -1.307 . . . . 27.12 110.186 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.03 -53.15 60.43 Favored 'General case' 0 C--O 1.257 1.451 0 O-C-N 126.241 2.213 . . . . 17.06 110.497 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.26 -38.63 90.02 Favored 'General case' 0 C--O 1.257 1.49 0 C-N-CA 118.29 -1.364 . . . . 17.53 111.571 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -47.06 86.94 Favored Glycine 0 CA--C 1.539 1.557 0 N-CA-C 110.134 -1.187 . . . . 16.9 110.134 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -63.18 -37.54 87.62 Favored 'General case' 0 C--O 1.257 1.487 0 CA-C-O 118.209 -0.901 . . . . 18.47 110.831 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' LEU . . . . . . . . . . . . . 14.2 tp -57.96 -44.4 87.0 Favored 'General case' 0 C--O 1.267 1.987 0 C-N-CA 125.78 1.632 . . . . 15.73 109.847 177.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.94 -26.08 62.14 Favored 'General case' 0 C--O 1.254 1.334 0 CA-C-O 117.954 -1.022 . . . . 18.49 113.153 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' VAL . . . . . . . . . . . . . 51.1 t -85.12 -50.16 14.95 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 O-C-N 126.114 2.134 . . . . 15.16 110.797 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 57.1 t -70.19 -38.2 73.96 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 O-C-N 125.531 1.769 . . . . 15.45 113.98 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -123.82 76.88 57.29 Favored Pre-proline 0 N--CA 1.479 1.021 0 N-CA-C 106.805 -1.554 . . . . 19.84 106.805 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.36 -22.45 33.74 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 O-C-N 126.366 2.772 . . . . 17.49 117.436 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -68.38 -17.07 64.15 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 120.046 1.294 . . . . 20.28 110.36 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' THR . . . . . . . . . . . . . 67.9 p -68.12 -19.8 64.86 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.004 0.921 . . . . 16.42 109.616 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -61.17 -20.32 62.59 Favored 'General case' 0 C--O 1.245 0.83 0 C-N-CA 124.657 1.183 . . . . 24.85 111.152 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -49.95 -34.8 21.85 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 126.023 2.077 . . . . 25.59 112.005 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -88.0 -5.78 58.33 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 122.573 2.442 . . . . 24.29 116.109 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -122.58 39.82 3.83 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.034 1.124 . . . . 30.18 114.034 -174.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.12 -42.35 98.37 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.485 -0.779 . . . . 54.61 110.702 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' SER . . . . . . . . . . . . . 78.7 p -64.49 -18.77 65.1 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 127.203 2.201 . . . . 43.27 113.07 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -65.19 -22.2 66.86 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 117.343 -1.313 . . . . 38.47 110.936 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 114.29 -135.12 12.19 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.214 0.946 . . . . 41.72 112.909 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -81.03 124.79 29.46 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.159 1.783 . . . . 50.99 111.799 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.92 11.15 3.36 Favored 'General case' 0 N--CA 1.482 1.167 1 O-C-N 129.237 4.086 . . . . 41.79 109.937 -177.231 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 66.0 p -56.19 -33.49 65.35 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 116.524 2.046 . . . . 46.22 116.524 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' THR . . . . . . . . . . . . . 28.6 p -129.46 166.26 19.96 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.47 -0.769 . . . . 38.85 112.52 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.49 -35.06 71.63 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 123.818 1.77 . . . . 32.1 110.642 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -73.61 -43.11 60.48 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.055 -1.429 . . . . 44.88 113.646 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.85 -48.69 80.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 125.418 1.699 . . . . 29.05 108.428 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' VAL . . . . . . . . . . . . . 46.9 t -60.8 -51.66 70.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 122.729 1.252 . . . . 25.33 111.648 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' MET . . . . . . . . . . . . . 83.3 mmm -63.32 -39.95 95.97 Favored 'General case' 0 C--O 1.257 1.48 0 CA-C-O 118.424 -0.798 . . . . 32.61 112.114 -176.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -87.5 -9.93 53.17 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 116.66 -1.638 . . . . 43.99 113.598 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -56.19 116.57 12.92 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-O 122.863 1.316 . . . . 30.5 111.222 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.31 -23.86 75.51 Favored 'Trans proline' 0 C--O 1.248 1.017 0 C-N-CA 123.395 2.73 . . . . 27.6 114.41 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -80.48 -37.22 32.2 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 125.632 1.832 . . . . 43.71 110.482 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.13 -46.84 93.95 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 CA-C-O 125.154 2.407 . . . . 23.88 108.116 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -59.64 -47.34 85.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 111.44 -2.618 . . . . 51.79 111.806 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.5 -44.22 91.63 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.546 -0.752 . . . . 22.91 110.267 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -66.7 -39.06 87.91 Favored 'General case' 0 C--O 1.258 1.524 0 O-C-N 125.729 1.893 . . . . 24.63 111.534 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . -55.35 -44.42 84.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 114.051 -1.432 . . . . 22.78 112.577 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 tttp -64.58 -47.49 78.48 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 126.253 1.821 . . . . 42.37 109.554 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -55.33 -50.28 70.03 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 112.698 -2.046 . . . . 39.75 109.388 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' VAL . . . . . . . . . . . . . 69.3 t -61.08 -42.51 93.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 124.94 1.4 . . . . 20.15 111.574 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.73 -28.82 66.13 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 115.1 1.519 . . . . 27.06 115.1 -177.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -67.39 -42.73 82.88 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 123.933 1.825 . . . . 41.7 106.747 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' SER . . . . . . . . . . . . . 26.1 t -62.42 -43.6 98.42 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 112.365 -2.198 . . . . 26.43 108.213 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -55.44 -51.62 66.29 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 114.098 -1.41 . . . . 25.57 108.093 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' SER . . . . . . . . . . . . . 69.2 m -54.26 -38.16 65.49 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 124.965 1.306 . . . . 26.88 111.589 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.86 -39.9 90.89 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 125.114 1.509 . . . . 47.94 109.598 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . -62.08 -37.81 95.07 Favored Glycine 0 N--CA 1.468 0.786 0 O-C-N 126.891 2.619 . . . . 31.97 110.204 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' MET . . . . . . . . . . . . . 90.3 mmm -59.87 -24.16 64.02 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 125.462 1.505 . . . . 32.19 112.843 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.82 -12.25 45.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 118.195 -0.907 . . . . 44.89 109.354 -179.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.93 44.99 2.78 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-O 116.464 -1.731 . . . . 46.14 114.487 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 24.5 mt -55.96 -23.35 31.69 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.792 1.308 . . . . 35.92 113.729 -177.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.32 -15.71 56.28 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 126.592 1.957 . . . . 56.84 112.807 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.65 71.26 0.98 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.014 -0.674 . . . . 44.71 110.479 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' LEU . . . . . . . . . . . . . 32.4 mt -68.52 -39.01 81.37 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 126.481 2.363 . . . . 32.6 108.171 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 25.9 mttp -58.62 -45.69 88.67 Favored 'General case' 0 C--O 1.249 1.046 0 O-C-N 125.873 1.983 . . . . 48.54 113.825 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.14 -45.45 61.94 Favored Glycine 0 N--CA 1.47 0.951 0 O-C-N 129.013 3.945 . . . . 30.43 109.227 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 33.6 m -59.68 -44.99 93.4 Favored 'General case' 0 C--O 1.254 1.29 0 N-CA-C 114.408 1.262 . . . . 28.87 114.408 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -99.0 0.71 44.44 Favored 'General case' 0 C--O 1.254 1.321 0 N-CA-C 116.498 2.036 . . . . 30.29 116.498 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -48.11 -50.28 29.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 120.444 1.475 . . . . 22.87 114.223 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.69 81.0 Favored 'General case' 0 C--O 1.25 1.107 0 O-C-N 120.605 -1.309 . . . . 21.1 112.42 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mt -68.99 -34.17 74.86 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 117.806 -1.093 . . . . 22.16 111.537 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 44.2 t -57.06 -55.8 30.02 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 127.485 2.991 . . . . 16.04 107.263 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -55.02 -48.01 73.94 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.303 2.252 . . . . 49.65 111.974 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' LEU . . . . . . . . . . . . . 3.6 tp -61.41 -42.6 98.98 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 113.823 -1.535 . . . . 24.19 111.531 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -67.36 -31.3 71.46 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 125.423 1.702 . . . . 16.56 109.818 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.76 -62.94 1.53 Allowed 'General case' 0 C--O 1.244 0.777 0 O-C-N 124.183 0.927 . . . . 17.35 111.028 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -69.23 -43.87 73.18 Favored 'General case' 0 C--O 1.255 1.343 0 N-CA-C 116.907 2.188 . . . . 32.99 116.907 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' LYS . . . . . . . . . . . . . 9.1 mptt -98.22 -38.33 9.34 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 117.835 -1.546 . . . . 43.98 113.667 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 85.8 mt -88.59 -26.48 21.92 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.998 1.481 . . . . 21.73 114.998 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 58.43 43.0 20.32 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 125.055 1.472 . . . . 27.42 110.656 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -88.85 117.13 31.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 C-N-CA 124.72 1.208 . . . . 16.28 110.961 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -59.09 122.92 66.73 Favored Pre-proline 0 C--O 1.255 1.378 0 N-CA-C 104.609 -2.367 . . . . 15.77 104.609 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.18 -24.77 51.91 Favored 'Trans proline' 0 C--N 1.325 -0.658 0 C-N-CA 123.32 2.68 . . . . 12.26 112.586 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tp10 -54.12 -32.52 55.32 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 121.063 -1.023 . . . . 32.23 110.122 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -58.74 -36.95 75.15 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 120.151 -1.593 . . . . 25.73 112.303 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -61.17 -36.26 79.34 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 106.697 -1.594 . . . . 14.96 106.697 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -70.36 -45.14 66.68 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 126.482 2.364 . . . . 37.52 109.133 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 23.4 mt -59.49 -41.35 89.61 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 124.222 0.951 . . . . 15.98 111.814 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.61 -39.42 77.23 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 115.747 -0.661 . . . . 19.02 110.508 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' GLY . . . . . . . . . . . . . . . -59.21 -45.11 95.86 Favored Glycine 0 N--CA 1.48 1.617 0 N-CA-C 108.122 -1.991 . . . . 18.96 108.122 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -65.85 -45.35 82.5 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 120.738 -1.448 . . . . 34.56 112.818 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' VAL . . . . . . . . . . . . . 35.0 t -60.44 -39.69 81.88 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 CA-C-O 123.09 1.424 . . . . 16.34 109.536 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 22.5 tp -64.54 -41.81 96.12 Favored 'General case' 0 C--O 1.252 1.203 0 O-C-N 119.628 -1.92 . . . . 17.48 108.678 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' VAL . . . . . . . . . . . . . 28.2 m -65.97 -34.16 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 107.376 -1.342 . . . . 20.89 107.376 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.75 -36.37 75.68 Favored 'Isoleucine or valine' 0 C--O 1.254 1.317 0 CA-C-N 119.161 0.891 . . . . 20.29 110.679 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 5.1 t -71.07 -40.32 75.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 O-C-N 126.511 2.382 . . . . 18.46 107.626 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' LEU . . . . . . . . . . . . . 30.9 mt -60.08 -43.15 95.69 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 123.477 1.608 . . . . 20.81 108.697 179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.79 -48.69 80.67 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.589 1.185 . . . . 22.73 111.335 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -27.58 69.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-N 114.505 -1.225 . . . . 38.48 113.248 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -90.44 -28.74 18.41 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 114.662 -2.59 . . . . 29.58 113.089 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -108.95 -2.02 18.6 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 115.072 1.508 . . . . 29.56 115.072 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.72 -130.71 5.14 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.446 -1.062 . . . . 28.85 110.446 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.01 -19.0 27.73 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 116.274 -1.822 . . . . 49.27 114.618 -176.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -70.86 -25.03 62.63 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 125.96 2.037 . . . . 46.58 112.16 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -87.83 75.26 8.91 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 127.078 2.736 . . . . 31.29 107.331 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' THR . . . . . . . . . . . . . 29.9 p -69.49 159.85 81.83 Favored Pre-proline 0 C--N 1.314 -0.959 0 N-CA-C 117.552 2.427 . . . . 26.17 117.552 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.55 -40.89 45.68 Favored 'Trans proline' 0 C--O 1.259 1.565 0 O-C-N 123.423 1.223 . . . . 25.83 111.684 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 91.0 t -70.26 -39.0 76.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 120.853 -1.155 . . . . 25.55 111.987 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.91 -53.42 54.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.042 -1.435 . . . . 30.86 107.666 -179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -52.48 -43.0 64.74 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 125.718 1.886 . . . . 27.81 111.288 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.08 -42.8 95.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.74 1.275 . . . . 22.17 109.509 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.22 -45.33 93.83 Favored 'General case' 0 C--N 1.314 -0.957 0 O-C-N 126.435 2.335 . . . . 32.61 110.503 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -67.03 -34.71 78.31 Favored 'General case' 0 C--O 1.248 1.015 0 O-C-N 125.013 1.445 . . . . 37.75 111.127 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -59.7 -37.91 80.12 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 126.874 2.609 . . . . 26.28 107.39 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -69.65 -39.41 77.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.988 -1.006 . . . . 30.53 111.407 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' VAL . . . . . . . . . . . . . 37.4 t -63.54 -55.58 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.787 1.28 . . . . 18.19 110.852 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' VAL . . . . . . . . . . . . 0.306 2.3 t -51.34 -40.42 23.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 CA-C-N 112.099 -2.319 . . . . 17.69 111.932 179.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.35 -50.16 48.89 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.676 1.59 . . . . 15.92 108.72 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' GLY . . . . . . . . . . . . . . . -61.24 -36.51 92.54 Favored Glycine 0 N--CA 1.478 1.436 0 CA-C-O 118.05 -1.417 . . . . 18.56 110.328 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.28 -49.27 62.5 Favored 'Isoleucine or valine' 0 C--O 1.25 1.091 0 CA-C-N 119.75 1.775 . . . . 16.67 110.564 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.2 -39.63 69.85 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.259 1.028 . . . . 17.95 109.315 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -69.9 -42.43 73.39 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 114.874 -2.489 . . . . 49.61 111.362 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.37 -38.47 90.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 127.647 3.092 . . . . 21.29 108.974 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' LEU . . . . . . . . . . . . . 13.1 mt -69.88 -24.46 63.42 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.84 1.422 . . . . 20.27 114.84 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.02 -8.44 33.61 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 125.785 2.707 . . . . 25.77 116.58 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . 0.317 1.6 t-80 -63.74 -24.36 67.74 Favored 'General case' 0 C--O 1.261 1.673 0 CA-C-N 112.149 -2.296 . . . . 50.94 116.342 -174.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -104.33 12.57 33.39 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-N 121.386 1.903 . . . . 56.23 111.695 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -68.44 144.91 54.52 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 105.715 -1.957 . . . . 24.06 105.715 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' HIS . . . . . . . . . . . . . 34.5 p80 . . . . . 0 C--O 1.262 1.732 0 CA-C-O 114.002 -2.904 . . . . 36.49 108.305 -178.646 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 148' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 752' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 759' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 762' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 769' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 770' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 771' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 772' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 773' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 776' ' ' HOH . . . . . 0.695 ' O ' ' OD1' ' A' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 781' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 782' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 786' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 788' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 789' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 790' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 751' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 753' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 754' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 763' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 766' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 775' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 777' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 783' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 756' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 761' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 774' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 778' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 779' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 780' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 784' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 787' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 791' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 792' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 760' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 768' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 793' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 794' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.258 1.504 0 CA-C-O 117.699 -1.144 . . . . 45.9 109.917 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.25 123.9 27.86 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.751 3.157 . . . . 37.25 112.048 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 p -80.8 173.61 12.43 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 117.099 -1.841 . . . . 28.88 107.445 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -41.67 97.47 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.269 -1.382 . . . . 24.58 107.269 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.08 -43.55 95.4 Favored 'General case' 0 C--O 1.243 0.762 0 O-C-N 126.416 2.322 . . . . 22.59 112.644 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . 0.42 ' OD2' ' HE2' ' A' ' 127' ' ' LYS . 78.6 m-20 -59.5 -48.97 79.6 Favored 'General case' 0 C--O 1.246 0.897 0 O-C-N 127.189 2.806 . . . . 17.84 109.086 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -57.79 -43.98 85.99 Favored 'General case' 0 C--O 1.265 1.882 0 O-C-N 125.319 1.637 . . . . 26.58 111.663 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.94 -43.87 98.6 Favored Glycine 0 CA--C 1.542 1.735 0 CA-C-O 125.21 2.561 . . . . 17.19 111.317 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.95 -46.07 88.94 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 117.622 -3.281 . . . . 21.85 110.456 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -67.51 -44.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 O-C-N 126.01 2.068 . . . . 15.96 109.589 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -59.87 -45.48 92.34 Favored 'General case' 0 C--N 1.316 -0.868 0 O-C-N 125.169 1.543 . . . . 36.16 108.921 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -53.29 57.69 Favored 'General case' 0 C--N 1.315 -0.927 0 O-C-N 121.38 -0.825 . . . . 19.26 112.283 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.35 99.02 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 124.48 1.113 . . . . 21.02 111.522 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -67.0 -30.49 70.61 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 122.082 0.944 . . . . 24.73 109.03 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.76 -32.48 84.32 Favored Glycine 0 N--CA 1.469 0.873 0 CA-C-N 113.807 -1.542 . . . . 26.61 110.007 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.79 -24.88 44.34 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.191 -1.182 . . . . 55.34 111.213 -179.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -68.67 -47.22 77.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 124.497 2.094 . . . . 28.39 105.447 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 43.54 -120.26 2.89 Favored Glycine 0 C--N 1.319 -0.416 0 CA-C-N 112.717 -2.038 . . . . 31.23 111.888 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.35 -16.34 54.04 Favored Glycine 0 C--O 1.248 1.007 0 C-N-CA 126.496 1.998 . . . . 30.68 117.381 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -86.64 -3.79 59.08 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-O 116.127 -1.892 . . . . 42.05 115.653 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -55.73 6.44 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 128.169 3.418 . . . . 20.37 112.024 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.37 -42.8 78.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.282 0.633 . . . . 16.8 111.007 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -63.33 -44.22 95.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 117.818 -1.087 . . . . 46.64 113.204 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -66.95 -31.45 72.03 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 126.615 2.447 . . . . 24.99 110.12 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.7 -47.21 88.69 Favored Glycine 0 CA--C 1.531 1.053 0 O-C-N 125.588 1.805 . . . . 15.22 109.639 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -40.6 82.46 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 112.393 -1.904 . . . . 14.82 107.915 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -70.44 -39.15 74.54 Favored 'General case' 0 C--N 1.317 -0.81 0 O-C-N 123.576 0.547 . . . . 20.19 111.793 178.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.16 -42.02 94.02 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 119.779 -1.826 . . . . 10.06 110.265 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 53.3 mt -60.91 -49.53 77.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.204 -1.362 . . . . 11.87 110.584 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.84 -41.07 86.08 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 125.146 1.529 . . . . 40.71 109.778 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.6 mtt-85 -67.44 -39.23 85.41 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.437 -0.949 . . . . 16.39 108.437 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 52.6 ttp -60.68 -44.51 96.4 Favored 'General case' 0 C--O 1.249 1.062 0 CA-C-O 123.003 1.382 . . . . 12.26 111.294 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -64.01 -38.89 92.71 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-O 117.412 -1.28 . . . . 14.91 111.711 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -76.32 -46.2 28.77 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 126.679 2.487 . . . . 24.56 113.76 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . 0.43 ' HB3' ' HG3' ' B' ' 131' ' ' GLN . 4.7 m -75.85 -30.49 58.95 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-O 115.543 -2.17 . . . . 22.62 111.934 -177.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -131.56 79.21 69.6 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 126.532 2.395 . . . . 16.63 110.805 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -57.24 -26.33 69.44 Favored 'Trans proline' 0 C--N 1.32 -0.94 0 C-N-CA 123.291 2.661 . . . . 14.94 115.109 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -61.88 -19.31 62.5 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 119.147 0.885 . . . . 12.21 112.535 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 p -69.3 -21.51 63.86 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 121.214 0.53 . . . . 11.82 111.318 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -67.79 -18.05 64.73 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 117.194 -1.384 . . . . 16.8 112.171 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.1 p -65.99 -15.33 62.92 Favored 'General case' 0 C--O 1.256 1.423 0 O-C-N 125.754 1.908 . . . . 14.6 111.595 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -91.38 -5.29 54.71 Favored 'General case' 0 C--O 1.254 1.299 0 O-C-N 125.066 1.478 . . . . 16.09 113.431 178.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.76 58.13 34.04 Favored Pre-proline 0 N--CA 1.482 1.167 0 O-C-N 124.736 1.272 . . . . 18.72 110.278 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.0 -18.9 52.19 Favored 'Trans proline' 0 C--O 1.243 0.75 0 CA-C-O 116.203 -1.665 . . . . 21.3 113.423 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -114.76 25.62 10.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.173 1.546 . . . . 38.87 115.173 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.62 145.86 29.73 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 128.607 3.692 . . . . 23.04 107.499 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -87.66 107.45 18.63 Favored 'General case' 0 C--N 1.31 -1.109 1 N-CA-C 97.912 -4.848 . . . . 36.13 97.912 171.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.07 9.88 40.87 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 125.097 1.498 . . . . 30.11 113.445 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 78.6 p -61.91 151.67 34.12 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 106.907 -1.516 . . . . 30.64 106.907 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.03 128.89 39.4 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 114.441 -1.254 . . . . 47.16 107.844 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.89 0.14 87.57 Favored Glycine 0 C--O 1.25 1.122 0 N-CA-C 117.296 1.679 . . . . 28.98 117.296 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.95 142.49 24.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.395 1.598 . . . . 26.56 112.166 -179.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.93 73.34 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.427 1.091 . . . . 21.12 110.912 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -64.18 -47.22 80.65 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.155 0.982 . . . . 27.65 111.157 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.31 -37.32 75.53 Favored 'Isoleucine or valine' 0 C--O 1.248 1.018 0 O-C-N 123.522 0.514 . . . . 19.86 110.314 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -65.91 -42.76 89.76 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.373 -0.831 . . . . 44.96 108.898 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.7 -41.36 95.91 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.292 -1.123 . . . . 14.95 110.292 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -71.81 -37.94 70.28 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-O 121.214 0.531 . . . . 19.03 110.654 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.52 -34.76 87.04 Favored Glycine 0 N--CA 1.469 0.861 0 CA-C-O 123.981 1.878 . . . . 14.33 110.51 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.64 -37.69 65.25 Favored 'General case' 0 C--O 1.26 1.656 0 CA-C-N 113.916 -1.142 . . . . 17.38 110.554 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -69.08 -42.05 76.72 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 125.308 1.63 . . . . 34.84 110.098 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.29 -47.59 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 N-CA-C 107.716 -1.216 . . . . 11.21 107.716 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.11 -36.99 78.67 Favored 'General case' 0 C--O 1.254 1.318 0 O-C-N 124.498 1.123 . . . . 12.06 113.684 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.31 -35.03 71.13 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 125.424 1.702 . . . . 10.54 110.15 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.45 97.83 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 120.99 -1.069 . . . . 11.87 108.93 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 mt -64.32 -40.02 95.07 Favored 'General case' 0 C--O 1.248 1.026 0 O-C-N 124.747 1.279 . . . . 15.32 110.019 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 98.8 m -60.29 -41.25 92.97 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 114.987 -1.006 . . . . 16.68 108.755 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -66.76 -34.4 77.75 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 123.23 1.49 . . . . 36.26 108.867 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.55 -49.94 71.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.952 -1.129 . . . . 14.86 107.952 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.406 ' HA ' HD13 ' A' ' 73' ' ' LEU . 31.1 t -55.95 -32.57 33.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 CA-C-O 121.875 0.845 . . . . 21.19 112.741 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.85 -17.48 57.33 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 116.428 2.01 . . . . 52.11 116.428 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -130.93 49.66 2.3 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 126.929 2.092 . . . . 32.07 110.039 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -59.93 -21.89 61.72 Favored 'General case' 0 C--O 1.256 1.399 0 O-C-N 126.223 2.202 . . . . 27.02 111.393 -177.807 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.69 2.44 55.57 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.581 1.153 . . . . 28.74 111.904 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -152.16 56.0 0.83 Allowed 'General case' 0 C--N 1.315 -0.921 0 O-C-N 120.484 -1.385 . . . . 20.14 112.216 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . 0.46 ' N ' ' CD ' ' A' ' 77' ' ' PRO . 0.0 OUTLIER -57.07 -46.76 99.83 Favored Pre-proline 0 C--N 1.309 -1.155 0 O-C-N 126.085 2.115 . . . . 25.2 110.063 -179.09 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 76' ' ' LEU . 44.9 Cg_exo -59.77 -35.21 95.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.909 3.072 . . . . 20.44 114.06 -179.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.58 -44.43 8.55 Favored Glycine 0 C--O 1.246 0.872 0 N-CA-C 108.377 -1.889 . . . . 21.06 108.377 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.39 -32.47 73.29 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 113.235 0.828 . . . . 26.69 113.235 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.5 mt -113.02 22.94 13.88 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.231 -2.795 . . . . 25.2 115.166 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.1 p -60.68 -48.32 82.32 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.658 -2.592 . . . . 32.88 112.519 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.57 -44.83 85.58 Favored 'General case' 0 C--O 1.256 1.434 0 O-C-N 127.139 2.775 . . . . 58.54 110.383 -179.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.4 mt -67.45 -26.26 66.31 Favored 'General case' 0 C--O 1.248 1.016 0 CA-C-O 112.948 -3.406 . . . . 24.86 112.431 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -72.23 -41.58 66.7 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 127.384 2.927 . . . . 24.27 109.085 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -60.34 -50.69 72.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 111.014 -2.812 . . . . 33.51 107.505 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.11 -51.36 69.93 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 126.929 2.643 . . . . 17.49 111.729 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 91' ' ' LEU . 66.5 m80 -64.82 -40.74 95.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 117.7 -1.6 . . . . 15.87 112.776 -179.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.09 84.6 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 116.086 1.884 . . . . 17.96 116.086 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.74 -24.8 14.89 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 119.01 2.967 . . . . 35.42 119.01 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -113.5 -64.06 1.36 Allowed 'General case' 0 C--O 1.248 1.0 0 O-C-N 124.362 1.039 . . . . 44.42 113.236 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' HIS . 80.0 mt -60.19 -49.55 77.18 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 125.183 1.393 . . . . 19.14 114.114 -177.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 48.95 56.15 8.19 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 126.952 2.657 . . . . 29.61 113.831 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -82.15 124.24 38.98 Favored 'Isoleucine or valine' 0 C--O 1.25 1.125 0 CA-C-N 111.338 -2.665 . . . . 14.03 108.081 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -54.84 132.87 66.39 Favored Pre-proline 0 N--CA 1.48 1.058 0 O-C-N 124.894 1.371 . . . . 23.33 109.742 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -47.2 -29.55 9.38 Favored 'Trans proline' 0 C--O 1.262 1.695 0 C-N-CA 124.614 3.542 . . . . 18.21 118.528 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.8 m -62.5 -31.83 53.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 119.802 1.183 . . . . 23.94 111.821 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -63.0 -24.27 67.84 Favored 'General case' 0 C--O 1.247 0.968 0 CA-C-O 113.63 -3.081 . . . . 18.13 112.854 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -64.35 -38.53 91.35 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 128.614 3.696 . . . . 15.34 110.598 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -65.39 -36.99 85.64 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 125.731 1.895 . . . . 48.89 110.526 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 48.2 mt -65.71 -39.83 91.62 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 125.082 1.489 . . . . 12.62 112.424 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.06 -39.67 65.71 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 120.916 -1.115 . . . . 9.65 109.81 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.2 m -57.35 -50.5 72.75 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 109.533 -0.543 . . . . 11.72 109.533 179.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.59 -47.81 81.09 Favored 'General case' 0 C--O 1.262 1.737 0 O-C-N 125.693 1.871 . . . . 11.65 110.878 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 67.8 m -60.41 -36.51 78.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.306 1.042 . . . . 15.97 110.701 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 tp -70.19 -38.44 75.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 113.81 -1.541 . . . . 30.72 111.382 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -45.48 91.49 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 124.835 1.254 . . . . 13.89 108.209 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.54 -46.54 95.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 114.852 -1.067 . . . . 11.45 109.263 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.7 m -59.67 -52.18 66.61 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 123.682 0.614 . . . . 12.28 110.745 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.0 -47.62 80.41 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 124.423 1.077 . . . . 14.3 111.237 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.3 -43.95 83.65 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 117.402 -1.285 . . . . 18.46 110.993 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.0 p -70.11 -25.47 63.51 Favored 'General case' 0 C--O 1.246 0.894 0 O-C-N 124.807 1.317 . . . . 20.83 111.157 -176.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -93.58 -22.47 18.79 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 114.458 1.281 . . . . 21.39 114.458 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.05 63.05 65.26 Favored Pre-proline 0 C--O 1.249 1.072 0 CA-C-N 119.215 0.916 . . . . 25.32 110.477 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -53.88 -42.48 66.23 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 O-C-N 124.078 1.567 . . . . 19.15 115.945 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.5 m -74.26 -31.24 62.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 126.176 1.79 . . . . 31.04 112.722 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . 0.695 ' OD1' ' O ' ' A' ' 776' ' ' HOH . 3.6 m-20 -91.25 -18.94 23.57 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.777 1.399 . . . . 32.95 114.777 -178.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -80.97 66.41 6.48 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 125.617 2.627 . . . . 20.43 111.792 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.6 p -78.47 163.13 63.22 Favored Pre-proline 0 C--O 1.252 1.217 0 CA-C-N 113.376 -1.738 . . . . 12.75 108.4 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -47.71 -47.12 19.23 Favored 'Trans proline' 0 C--O 1.252 1.22 0 C-N-CA 121.853 1.702 . . . . 12.42 110.363 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.41 96.94 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 117.405 -1.284 . . . . 12.79 112.555 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.5 t -66.69 -40.16 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 123.962 1.839 . . . . 12.67 111.828 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -54.07 -53.83 47.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 124.133 1.92 . . . . 14.45 108.9 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.24 -42.63 86.77 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.527 -1.358 . . . . 14.22 111.486 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.4 m -69.14 -40.94 77.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 117.695 -1.145 . . . . 14.11 111.426 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 53.0 mt -66.68 -42.79 85.94 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 124.974 1.421 . . . . 11.8 109.886 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -56.86 -46.33 81.87 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 125.197 1.561 . . . . 19.72 107.461 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.436 ' HD2' ' HG3' ' C' ' 141' ' ' ARG . 0.5 OUTLIER -65.79 -41.28 92.17 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 124.377 1.048 . . . . 19.88 111.827 179.826 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -59.65 -49.31 78.24 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 124.392 1.057 . . . . 10.13 109.064 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.46 -40.6 97.14 Favored 'General case' 0 C--O 1.252 1.237 0 C-N-CA 117.604 -1.639 . . . . 9.3 110.651 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.63 -41.31 90.17 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 119.7 -0.8 . . . . 12.39 108.846 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.76 -33.07 73.28 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 122.299 1.047 . . . . 34.47 110.717 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.62 -42.82 77.97 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 N-CA-C 107.364 -1.347 . . . . 11.96 107.364 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 39.9 m -57.2 -46.79 82.55 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 126.122 2.868 . . . . 15.34 114.269 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.6 m -59.21 -43.87 92.28 Favored 'General case' 0 C--O 1.257 1.476 0 C-N-CA 126.305 1.842 . . . . 14.89 111.366 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.5 t -64.7 -44.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 O-C-N 125.701 1.876 . . . . 12.85 110.372 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -62.33 -31.87 72.56 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 127.087 2.155 . . . . 13.6 113.466 -178.183 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.1 p -105.74 13.08 30.21 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 112.576 0.584 . . . . 17.45 112.576 178.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.1 p -71.63 -16.66 62.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.475 2.398 . . . . 18.36 117.475 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -106.32 7.22 31.18 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 127.006 2.122 . . . . 33.62 111.997 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.17 -37.54 77.61 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 125.624 1.828 . . . . 21.12 114.856 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.4 ptt180 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 116.152 -1.88 . . . . 27.6 111.846 -179.982 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' MET . . . . . 0.588 ' HE3' ' HG ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.238 0.479 0 CA-C-O 121.241 0.543 . . . . 61.28 111.599 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . 0.588 ' HG ' ' HE3' ' B' ' 2' ' ' MET . 0.2 OUTLIER -69.82 171.11 9.77 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 129.362 3.065 . . . . 50.43 110.991 179.86 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . 0.455 ' OG1' ' HG2' ' B' ' 6' ' ' GLU . 4.8 p -81.31 167.7 19.23 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.007 -1.906 . . . . 39.72 109.259 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.22 -31.52 72.07 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 115.384 -0.825 . . . . 32.11 113.053 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 0.455 ' HG2' ' OG1' ' B' ' 4' ' ' THR . 0.6 OUTLIER -77.54 -36.28 52.42 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.751 1.221 . . . . 41.25 111.771 177.365 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -70.16 -43.46 70.81 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.996 1.435 . . . . 34.58 107.24 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -44.28 91.49 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 124.232 1.967 . . . . 49.67 108.271 179.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.81 99.37 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 114.365 -1.288 . . . . 23.15 110.236 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.0 75.1 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 125.691 1.596 . . . . 19.66 114.39 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -65.08 -44.77 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 114.611 -1.177 . . . . 18.25 108.604 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -56.46 -51.93 66.58 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 122.958 1.361 . . . . 26.29 111.526 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.06 97.91 Favored 'General case' 0 C--O 1.25 1.121 0 CA-C-N 111.403 -2.635 . . . . 25.49 111.542 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.55 -45.96 81.34 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 120.737 0.303 . . . . 29.66 110.476 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -56.16 -35.44 67.2 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 115.855 -0.611 . . . . 24.77 111.932 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.19 -12.87 18.38 Favored Glycine 0 N--CA 1.469 0.871 0 CA-C-O 119.232 -0.76 . . . . 30.14 112.937 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . 0.679 ' HE3' ' OE2' ' B' ' 121' ' ' GLU . 31.5 mttm -97.08 -9.61 27.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 126.434 1.894 . . . . 49.77 113.441 179.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -76.66 130.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 O-C-N 124.406 1.066 . . . . 30.84 113.495 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' CD ' ' B' ' 22' ' ' GLU . 2.6 mtpp -91.8 89.98 7.3 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 103.289 -2.856 . . . . 42.47 103.289 176.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 3.4 t -55.8 -40.14 59.91 Favored 'Isoleucine or valine' 0 C--O 1.263 1.789 0 N-CA-C 117.064 2.246 . . . . 30.89 117.064 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.58 -41.56 88.34 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 120.249 1.386 . . . . 47.35 110.696 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . 0.428 ' CD ' ' HE3' ' B' ' 19' ' ' LYS . 90.5 mt-10 -66.35 -54.25 26.81 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.228 2.205 . . . . 47.39 115.205 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.68 -37.1 79.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 113.05 -1.887 . . . . 22.89 108.971 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 68' ' ' LEU . . . -60.25 -57.1 20.9 Favored Glycine 0 C--O 1.255 1.438 0 C-N-CA 126.061 1.791 . . . . 18.03 112.013 179.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.68 -41.26 99.57 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 108.483 -1.847 . . . . 17.19 108.483 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.37 -50.94 69.56 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 116.99 -1.481 . . . . 21.82 111.04 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.05 -54.38 47.77 Favored 'General case' 0 C--O 1.253 1.242 0 O-C-N 126.354 2.284 . . . . 15.18 110.105 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.05 -45.88 89.64 Favored 'General case' 0 C--O 1.253 1.258 0 O-C-N 124.505 1.128 . . . . 13.96 112.099 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -58.58 -50.12 70.27 Favored Glycine 0 C--O 1.254 1.349 0 N-CA-C 108.888 -1.685 . . . . 14.25 108.888 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 54.6 mtt-85 -61.28 -37.1 81.97 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 117.882 0.841 . . . . 13.26 112.033 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 12.7 tp -57.45 -47.41 81.91 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.357 1.661 . . . . 12.41 110.086 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -24.57 65.76 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.13 1.159 . . . . 18.59 114.13 -178.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 55.3 t -87.26 -48.06 15.56 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 CA-C-O 117.097 -1.43 . . . . 15.7 111.462 -178.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 57.3 t -74.64 -32.74 29.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 CA-C-O 114.525 -2.655 . . . . 15.56 113.646 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -126.76 74.94 75.58 Favored Pre-proline 0 C--N 1.304 -1.406 0 C-N-CA 127.781 2.432 . . . . 25.29 106.155 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -55.62 -26.22 54.29 Favored 'Trans proline' 0 C--O 1.253 1.272 0 N-CA-C 116.5 1.692 . . . . 18.5 116.5 -175.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' TRP . . . . . 0.421 ' HA ' ' HG2' ' C' ' 92' ' ' ARG . 46.7 p90 -62.36 -18.83 62.51 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-N 121.322 1.874 . . . . 18.93 110.692 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 57.9 p -70.65 -14.62 62.54 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 120.007 1.276 . . . . 17.21 111.495 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.43 -22.85 65.4 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-N 112.491 -2.141 . . . . 21.73 111.266 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -50.65 -30.38 13.37 Favored 'General case' 0 C--O 1.253 1.287 0 O-C-N 124.937 1.398 . . . . 27.28 113.258 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.08 -9.07 52.53 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 116.256 -1.83 . . . . 20.41 115.4 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -122.27 30.39 6.58 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 125.34 1.65 . . . . 25.3 114.231 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.65 -34.54 65.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 122.281 1.038 . . . . 51.02 111.743 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 92.9 p -70.2 -19.09 63.19 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-N 114.668 -1.151 . . . . 33.89 112.634 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -65.5 -16.41 63.63 Favored 'General case' 0 C--O 1.25 1.128 0 CA-C-O 117.053 -1.451 . . . . 31.37 111.445 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 112.65 -147.39 18.37 Favored Glycine 0 N--CA 1.477 1.375 0 C-N-CA 118.206 -1.949 . . . . 33.17 110.08 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -73.09 118.2 15.75 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.744 -1.228 . . . . 47.5 113.748 -178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 67.5 mt -129.09 19.46 5.94 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 125.958 2.037 . . . . 36.36 111.384 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 73.1 p -65.71 -31.83 73.05 Favored 'General case' 0 C--O 1.259 1.6 0 N-CA-C 118.508 2.781 . . . . 45.24 118.508 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 19.4 p -129.23 162.02 28.82 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.818 -0.808 . . . . 36.89 108.818 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' B' ' 55' ' ' MET . . . -51.99 -49.34 63.5 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.137 0.575 . . . . 30.89 110.102 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.45 -46.77 83.24 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 125.622 1.826 . . . . 50.17 112.981 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 57' ' ' ASN . . . -56.67 -43.74 80.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 123.974 1.845 . . . . 28.49 110.563 179.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.75 -53.0 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.598 -1.183 . . . . 26.06 110.809 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' B' ' 51' ' ' ALA . 87.3 mmm -64.1 -35.05 79.48 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-O 116.864 -1.541 . . . . 26.98 111.696 -176.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -90.31 -4.6 57.02 Favored 'General case' 0 C--O 1.251 1.157 0 O-C-N 124.422 1.076 . . . . 35.48 113.057 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 53' ' ' ALA . 20.0 t-20 -64.35 119.09 53.36 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 123.662 0.601 . . . . 25.23 110.927 -178.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -61.17 -33.11 91.23 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.71 2.273 . . . . 24.09 114.845 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -77.65 -31.83 52.93 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 124.749 1.281 . . . . 47.09 110.586 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 3.2 t -65.84 -39.52 84.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 125.09 2.376 . . . . 24.96 107.345 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -55.95 27.61 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 112.51 -2.132 . . . . 51.99 111.985 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.41 -47.45 86.05 Favored 'General case' 0 C--O 1.256 1.405 0 CA-C-N 114.758 -1.11 . . . . 20.04 110.856 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 39.5 t60 -63.01 -41.68 99.63 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 113.975 -1.466 . . . . 19.0 111.406 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -43.47 93.84 Favored Glycine 0 N--CA 1.471 1.001 0 N-CA-C 109.462 -1.455 . . . . 15.55 109.462 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 49.7 tttp -58.62 -48.13 82.05 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 124.227 1.011 . . . . 35.98 110.76 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -57.45 -50.39 73.18 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-N 113.128 -1.851 . . . . 26.68 112.508 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . 0.424 HG13 ' C3B' ' B' ' 148' ' ' HEM . 59.8 t -60.9 -45.38 98.35 Favored 'Isoleucine or valine' 0 C--O 1.255 1.365 0 CA-C-N 115.553 -0.749 . . . . 17.22 111.0 -178.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . 0.545 HD12 ' HB3' ' B' ' 71' ' ' PHE . 1.7 tp -71.4 -31.12 66.9 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 125.382 1.676 . . . . 19.04 113.265 -179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -64.54 -37.9 89.17 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 106.501 -1.666 . . . . 34.32 106.501 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -68.1 -43.65 78.0 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 126.066 2.104 . . . . 16.92 107.991 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PHE . . . . . 0.545 ' HB3' HD12 ' B' ' 68' ' ' LEU . 39.4 t80 -58.54 -45.1 89.6 Favored 'General case' 0 C--O 1.261 1.66 0 O-C-N 124.883 1.365 . . . . 18.95 110.019 176.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 57.5 m -55.0 -34.42 63.4 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 123.288 1.518 . . . . 22.47 113.148 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.65 -38.47 90.42 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 113.078 -1.874 . . . . 39.77 108.022 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.77 -34.73 83.75 Favored Glycine 0 N--CA 1.478 1.482 0 CA-C-N 113.39 -1.732 . . . . 23.79 110.117 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 92.8 mmm -60.05 -21.65 61.68 Favored 'General case' 0 C--O 1.247 0.937 0 O-C-N 126.437 1.904 . . . . 27.59 110.337 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.36 -11.33 46.52 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 125.42 1.7 . . . . 46.13 109.041 179.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -130.92 40.33 3.49 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 120.807 1.639 . . . . 39.9 115.033 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 14.8 mt -48.2 -18.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.609 1.337 . . . . 33.38 114.609 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -89.39 -31.45 17.75 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 115.271 -2.3 . . . . 49.01 111.276 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -130.43 68.31 1.47 Allowed 'General case' 0 C--O 1.247 0.969 0 O-C-N 126.013 2.071 . . . . 36.03 109.81 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 61.6 mt -67.72 -39.13 84.35 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 125.876 1.985 . . . . 25.72 109.948 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -56.42 -51.73 67.3 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.546 1.138 . . . . 48.3 111.389 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.29 -43.74 96.51 Favored Glycine 0 N--CA 1.473 1.104 0 O-C-N 126.483 2.365 . . . . 21.96 108.461 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 28.2 m -56.16 -45.6 79.63 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 116.381 -1.771 . . . . 21.35 114.389 -178.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -101.19 11.62 39.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 126.653 2.471 . . . . 24.19 114.656 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.33 -48.69 71.09 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 113.078 0.77 . . . . 19.25 113.078 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.55 91.15 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.275 0.984 . . . . 19.74 111.138 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.63 -28.45 62.76 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 116.729 -1.605 . . . . 19.2 111.814 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 28.4 t -65.34 -48.97 71.16 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 125.527 2.584 . . . . 17.82 107.42 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.64 -46.69 70.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 110.744 -2.935 . . . . 49.77 110.119 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.15 -46.24 81.7 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.163 0.915 . . . . 23.35 112.869 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -61.93 -32.27 72.67 Favored 'General case' 0 C--O 1.253 1.289 0 CA-C-O 122.877 1.323 . . . . 15.02 112.11 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.93 -63.7 1.35 Allowed 'General case' 0 C--O 1.257 1.48 0 CA-C-N 114.978 -1.01 . . . . 16.68 113.222 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -67.94 -45.37 74.47 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 113.699 -3.048 . . . . 33.51 114.725 -176.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' B' ' 95' ' ' LYS . 0.6 OUTLIER -95.22 -46.18 6.87 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 127.42 2.95 . . . . 40.21 114.56 179.692 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 mt -90.31 -16.35 29.43 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 114.116 -2.849 . . . . 21.5 114.494 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 35.1 m-70 52.48 45.31 28.79 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 123.488 2.858 . . . . 26.22 114.569 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -92.04 120.23 40.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 113.958 -1.474 . . . . 15.05 109.554 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 44.6 t0 -64.29 128.44 93.23 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 105.471 -2.048 . . . . 14.99 105.471 175.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 99' ' ' ASP . 4.1 Cg_exo -62.37 -14.42 38.74 Favored 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 124.088 3.192 . . . . 12.21 114.392 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -58.06 -33.85 69.47 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.132 -1.062 . . . . 30.23 108.132 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -59.0 -36.18 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.474 3.11 . . . . 19.01 110.929 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -65.16 -35.16 80.23 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-O 116.776 -1.583 . . . . 20.04 109.381 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -71.94 -41.68 67.53 Favored 'General case' 0 C--O 1.253 1.285 0 O-C-N 125.393 1.683 . . . . 35.71 111.175 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 24.2 mt -58.96 -51.31 70.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.507 -1.224 . . . . 19.12 107.852 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.16 -37.34 84.86 Favored 'General case' 0 C--O 1.255 1.39 0 O-C-N 124.125 0.891 . . . . 12.19 111.53 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.63 99.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 118.888 -1.625 . . . . 14.88 109.862 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -69.94 -37.84 75.98 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.452 -1.261 . . . . 29.14 111.679 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 17.8 t -67.67 -36.05 74.79 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 O-C-N 125.585 1.803 . . . . 13.53 110.072 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 58.1 tp -59.47 -44.21 93.06 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 113.405 -1.725 . . . . 10.87 108.884 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.74 -42.88 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 124.862 1.351 . . . . 14.56 111.7 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.35 -41.17 90.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 122.781 0.432 . . . . 13.16 110.182 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 t -62.67 -43.27 98.45 Favored 'Isoleucine or valine' 0 C--O 1.246 0.875 0 O-C-N 120.919 -1.113 . . . . 9.98 112.798 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.44 -41.07 96.62 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.539 1.161 . . . . 15.65 108.732 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.12 85.64 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.374 -1.285 . . . . 14.93 107.59 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -63.65 -46.2 86.74 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 119.772 -1.83 . . . . 18.75 110.928 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.86 -32.31 69.27 Favored 'General case' 0 C--O 1.257 1.459 0 CA-C-O 115.295 -2.288 . . . . 23.2 115.907 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -108.7 0.06 20.34 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.045 1.498 . . . . 31.95 115.045 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 49.84 -128.01 24.64 Favored Glycine 0 C--N 1.302 -1.337 0 O-C-N 125.263 1.602 . . . . 23.94 111.949 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -26.26 68.01 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 127.435 2.491 . . . . 51.71 113.793 -177.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLU . . . . . 0.679 ' OE2' ' HE3' ' B' ' 17' ' ' LYS . 52.9 tt0 -63.37 -29.11 70.47 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 122.939 1.352 . . . . 50.21 110.596 178.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -86.88 81.11 8.25 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 126.512 3.053 . . . . 24.08 105.62 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 43.6 p -72.18 160.66 82.13 Favored Pre-proline 0 C--O 1.25 1.081 0 CA-C-N 113.159 -1.837 . . . . 21.31 111.405 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.92 -36.85 92.96 Favored 'Trans proline' 0 C--O 1.257 1.426 0 CA-C-N 112.081 -1.792 . . . . 19.5 110.017 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 26.2 t -69.74 -42.64 80.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.86 0 CA-C-O 121.837 0.827 . . . . 21.25 111.545 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' B' ' 126' ' ' LEU . 4.3 tp -63.35 -45.64 90.27 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 112.514 -2.13 . . . . 29.61 106.973 178.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -57.98 -43.39 86.48 Favored 'General case' 0 C--O 1.256 1.441 0 O-C-N 121.648 -0.657 . . . . 16.51 110.643 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.25 -44.68 84.11 Favored 'General case' 0 C--O 1.246 0.895 0 O-C-N 125.14 1.525 . . . . 17.92 110.174 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -59.97 -43.6 94.96 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-O 115.829 -2.034 . . . . 26.15 112.09 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PHE . . . . . 0.443 ' O ' HG13 ' B' ' 134' ' ' VAL . 10.6 m-85 -69.35 -32.61 71.78 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 127.916 3.26 . . . . 20.35 113.517 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 1.5 mm100 -60.56 -42.52 96.77 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 107.941 -1.133 . . . . 20.31 107.941 176.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mttt -65.71 -38.19 88.51 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.09 -0.959 . . . . 37.07 108.723 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.92 -52.61 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 124.565 1.165 . . . . 17.82 112.502 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' VAL . . . . . 0.443 HG13 ' O ' ' B' ' 130' ' ' PHE . 3.6 m -60.24 -35.57 62.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 O-C-N 123.922 0.764 . . . . 12.87 108.969 -178.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.6 -41.34 84.21 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.724 -0.843 . . . . 15.5 108.724 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.19 -45.5 95.9 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 108.249 -1.94 . . . . 15.63 108.249 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . . 59.2 t -64.86 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 C-N-CA 119.689 -0.804 . . . . 16.23 112.456 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.48 88.3 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.771 0.828 . . . . 19.53 110.577 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.72 -37.69 82.58 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 124.498 1.124 . . . . 47.84 111.417 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.01 76.07 Favored 'General case' 0 C--O 1.248 1.017 0 O-C-N 124.939 1.4 . . . . 19.97 107.249 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.11 -23.19 65.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.479 1.659 . . . . 19.62 115.479 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.94 -20.14 26.31 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 127.317 2.247 . . . . 18.87 113.25 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' B' ' 775' ' ' HOH . 55.3 t-80 -53.35 -45.51 69.17 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 117.963 2.579 . . . . 49.07 117.963 -175.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -88.22 15.26 7.83 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 123.69 2.95 . . . . 60.15 114.191 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -75.14 147.07 40.82 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 107.76 -1.2 . . . . 24.22 107.76 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.264 1.824 0 O-C-N 126.644 2.465 . . . . 31.83 112.216 -178.026 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.242 0.669 0 CA-C-O 125.039 2.352 . . . . 47.53 110.009 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 29.5 mt -78.29 121.59 24.63 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 110.485 -3.052 . . . . 38.65 108.867 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 87.1 p -78.71 175.69 10.2 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 107.059 -1.46 . . . . 33.96 107.059 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.69 -43.09 94.2 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 126.79 2.556 . . . . 27.69 108.882 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.16 -34.17 76.98 Favored 'General case' 0 C--O 1.254 1.308 0 CA-C-N 113.156 -1.838 . . . . 24.81 111.691 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -63.63 -46.74 84.32 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 125.981 2.051 . . . . 22.28 110.671 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.93 -46.56 87.67 Favored 'General case' 0 C--O 1.259 1.6 1 O-C-N 129.662 4.351 . . . . 30.16 111.047 -178.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.28 82.81 Favored Glycine 0 C--O 1.248 1.018 0 CA-C-N 113.465 -1.698 . . . . 23.51 110.191 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -61.58 -41.34 97.27 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 113.011 0.745 . . . . 27.29 113.011 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 t -64.99 -49.4 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 125.927 2.017 . . . . 21.67 109.601 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -60.27 -46.8 88.54 Favored 'General case' 0 C--O 1.25 1.119 0 O-C-N 126.654 2.471 . . . . 32.63 109.952 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.06 -50.1 74.69 Favored 'General case' 0 C--O 1.258 1.542 0 C-N-CA 119.274 -0.97 . . . . 24.89 111.838 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.57 -36.14 83.25 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.072 1.138 . . . . 22.11 114.072 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -69.53 -32.73 71.73 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 122.95 1.357 . . . . 29.08 108.563 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.67 -48.6 83.98 Favored Glycine 0 CA--C 1.548 2.1 0 CA-C-N 113.045 -1.889 . . . . 32.43 108.523 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -66.96 -32.69 74.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 117.232 -1.366 . . . . 54.04 109.771 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 t -57.3 -47.93 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 105.919 -1.882 . . . . 29.73 105.919 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 52.84 -131.19 40.4 Favored Glycine 0 C--O 1.251 1.194 0 O-C-N 126.095 2.122 . . . . 32.78 110.867 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.17 -14.45 59.34 Favored Glycine 0 C--O 1.254 1.4 0 N-CA-C 118.158 2.023 . . . . 32.35 118.158 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.45 1.34 33.65 Favored 'General case' 0 C--O 1.257 1.472 0 N-CA-C 114.689 1.366 . . . . 36.73 114.689 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.91 -50.17 61.62 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 126.209 2.193 . . . . 25.04 111.833 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.07 82.0 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 122.489 1.138 . . . . 20.05 111.112 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -61.18 -48.03 83.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 112.943 -1.935 . . . . 52.03 112.706 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -64.47 -36.14 83.22 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.735 0.814 . . . . 25.84 112.291 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.9 -46.55 91.32 Favored Glycine 0 C--O 1.255 1.456 0 N-CA-C 107.351 -2.299 . . . . 18.73 107.351 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.38 84.15 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 118.818 -1.153 . . . . 18.84 110.843 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -69.84 -37.74 76.28 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.468 0.307 . . . . 30.33 110.57 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.07 -48.02 83.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.649 -1.612 . . . . 15.74 106.649 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 37.9 mt -54.24 -50.11 67.95 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 125.354 1.658 . . . . 22.0 114.117 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -59.83 -44.33 94.11 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 113.46 -1.7 . . . . 46.45 112.096 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 67.4 mtt-85 -62.06 -44.86 95.77 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 125.738 1.899 . . . . 24.16 108.437 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.65 -46.9 80.77 Favored 'General case' 0 C--O 1.264 1.822 0 C-N-CA 127.284 2.234 . . . . 17.23 111.527 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -65.86 -34.9 79.2 Favored 'General case' 0 C--O 1.258 1.537 0 CA-C-O 116.402 -1.761 . . . . 22.61 115.369 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 34.2 mt -77.89 -44.76 26.12 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.039 1.462 . . . . 27.62 112.833 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 1.5 m -68.38 -47.73 66.58 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 126.588 2.43 . . . . 19.88 113.081 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -122.09 77.14 41.7 Favored Pre-proline 0 C--O 1.253 1.244 0 C-N-CA 124.24 1.016 . . . . 18.91 111.662 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -50.29 -27.39 17.77 Favored 'Trans proline' 0 C--O 1.253 1.228 0 C-N-CA 123.783 2.989 . . . . 18.69 116.126 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 60.4 p -62.67 -23.78 67.29 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 124.274 1.03 . . . . 17.3 112.081 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 79.1 p -68.33 -18.53 64.52 Favored 'General case' 0 C--O 1.247 0.922 0 O-C-N 124.06 0.85 . . . . 12.96 110.699 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -72.5 -17.76 61.72 Favored 'General case' 0 C--O 1.251 1.143 0 O-C-N 124.918 1.386 . . . . 19.03 112.003 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 28.6 p -61.93 -18.46 60.39 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 116.716 -1.611 . . . . 15.3 111.351 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -89.49 -6.84 56.07 Favored 'General case' 0 C--O 1.255 1.382 0 N-CA-C 114.287 1.217 . . . . 17.31 114.287 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -125.97 49.01 3.27 Favored Pre-proline 0 N--CA 1.486 1.359 0 N-CA-C 113.249 0.833 . . . . 22.19 113.249 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -61.13 -30.77 89.58 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 C-N-CA 123.508 2.805 . . . . 26.93 114.632 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' HIS . . . . . 0.52 ' ND1' ' N ' ' C' ' 45' ' ' HIS . 14.0 p-80 -93.95 17.77 11.69 Favored 'General case' 0 C--O 1.255 1.392 0 O-C-N 120.78 -1.2 . . . . 37.47 111.681 -179.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -108.72 156.07 20.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.626 -1.25 . . . . 26.49 107.626 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.64 109.45 21.08 Favored 'General case' 0 C--O 1.247 0.959 1 N-CA-C 98.749 -4.537 . . . . 40.64 98.749 173.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.14 16.02 24.1 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 125.373 1.67 . . . . 32.77 113.873 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 70.9 p -67.33 163.43 20.66 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.27 1.606 . . . . 38.35 109.238 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -61.93 131.84 51.04 Favored 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.942 1.401 . . . . 42.69 107.364 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLY . . . . . 0.741 ' HA2' ' NZ ' ' C' ' 56' ' ' LYS . . . 72.6 11.36 77.03 Favored Glycine 0 C--O 1.258 1.64 0 N-CA-C 119.434 2.533 . . . . 33.22 119.434 179.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.8 142.4 35.01 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 125.041 1.083 . . . . 30.06 108.511 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.91 -40.52 93.44 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 125.642 1.577 . . . . 26.12 110.813 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.05 -48.19 80.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 112.854 -1.976 . . . . 28.57 110.579 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.6 t -66.22 -46.01 88.52 Favored 'Isoleucine or valine' 0 C--O 1.248 1.019 0 O-C-N 125.592 1.808 . . . . 23.6 108.823 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LYS . . . . . 0.741 ' NZ ' ' HA2' ' C' ' 51' ' ' GLY . 1.3 mtpp -62.48 -38.02 88.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 117.844 -1.542 . . . . 54.59 111.107 178.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.86 -46.88 90.57 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 110.701 -0.96 . . . . 19.87 110.701 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -66.97 -42.65 84.8 Favored 'General case' 0 C--O 1.256 1.398 0 O-C-N 126.282 1.813 . . . . 22.75 112.206 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.93 -37.13 76.77 Favored Glycine 0 C--O 1.27 2.385 0 O-C-N 119.161 -2.212 . . . . 18.34 111.459 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.88 76.57 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-O 118.233 -0.889 . . . . 16.2 110.429 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.3 mttp -71.7 -37.62 70.65 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.827 1.329 . . . . 33.11 111.446 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.09 -52.18 62.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 113.968 -1.469 . . . . 11.1 109.213 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.57 88.32 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 111.362 -2.654 . . . . 12.24 110.877 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.59 83.65 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.769 -0.826 . . . . 11.45 108.769 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.2 86.52 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 118.524 -1.27 . . . . 13.48 110.746 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 mt -60.62 -38.93 86.38 Favored 'General case' 0 C--O 1.256 1.447 0 CA-C-N 115.361 -0.836 . . . . 17.84 110.202 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -62.15 -41.45 98.31 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.071 -0.968 . . . . 20.22 109.283 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.89 -48.76 79.04 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.612 1.195 . . . . 46.47 109.71 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.68 -47.15 70.72 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.33 1.452 . . . . 24.29 111.836 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 97.7 t -60.51 -31.58 49.2 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 C-N-CA 125.32 1.448 . . . . 24.86 112.15 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . 0.257 25.4 mt-10 -79.0 -25.93 43.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 118.18 -0.914 . . . . 57.18 109.111 179.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 72' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -119.66 52.69 1.09 Allowed 'General case' 0 C--N 1.317 -0.819 0 O-C-N 124.548 1.155 . . . . 43.48 110.772 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 73' ' ' LEU . 16.5 mt -61.31 -31.54 71.39 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 124.882 1.364 . . . . 30.0 110.398 -178.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -80.23 10.24 4.72 Favored 'General case' 0 C--O 1.252 1.225 0 O-C-N 125.133 1.521 . . . . 46.91 112.903 -178.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -167.03 60.23 0.08 Allowed 'General case' 0 C--O 1.25 1.098 0 CA-C-N 118.68 0.673 . . . . 35.67 111.462 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' LEU . . . . . 0.631 ' N ' ' CD ' ' C' ' 77' ' ' PRO . 0.0 OUTLIER -56.87 -40.23 83.56 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 113.896 -1.502 . . . . 26.72 111.756 -179.309 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 77' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' C' ' 76' ' ' LEU . 44.1 Cg_exo -59.4 -39.55 75.6 Favored 'Trans proline' 0 C--O 1.254 1.286 0 C-N-CA 122.473 2.115 . . . . 25.66 113.427 -178.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.86 -42.25 13.21 Favored Glycine 0 N--CA 1.484 1.887 0 CA-C-O 124.635 2.242 . . . . 23.75 109.64 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.88 -35.72 73.46 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 113.387 -1.407 . . . . 25.26 111.194 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 77.7 mt -109.31 14.27 23.82 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-O 114.785 -2.531 . . . . 23.48 116.192 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' C' ' 84' ' ' SER . 13.8 p -50.46 -53.86 26.46 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-O 115.595 -2.145 . . . . 32.25 112.626 -177.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -66.86 -31.79 72.62 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-O 115.48 -2.2 . . . . 49.08 115.337 -179.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.63 -23.52 61.71 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 115.525 -2.178 . . . . 18.86 108.363 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' C' ' 81' ' ' SER . 3.2 m -66.93 -49.39 65.65 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.255 2.222 . . . . 20.15 109.088 178.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -64.62 -41.92 95.85 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 126.572 2.42 . . . . 34.49 108.65 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 20.4 tp -64.18 -43.47 95.02 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 113.451 0.908 . . . . 21.55 113.451 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -69.71 -43.79 71.7 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 117.197 -1.801 . . . . 18.65 109.569 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.55 -47.61 75.28 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 116.194 1.924 . . . . 16.04 116.194 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -95.27 -25.85 16.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 113.682 -3.056 . . . . 35.91 117.45 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 69.2 tttt -113.63 -60.47 1.88 Allowed 'General case' 0 C--N 1.317 -0.825 0 O-C-N 128.477 3.611 . . . . 39.37 115.055 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 59.4 mt -67.83 -45.71 73.89 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 119.787 1.176 . . . . 18.47 112.518 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' ARG . . . . . 0.421 ' HG2' ' HA ' ' B' ' 37' ' ' TRP . 3.0 mpp_? 51.17 55.27 9.77 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 125.245 1.418 . . . . 31.55 113.065 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 53.2 t -79.49 127.85 38.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 O-C-N 126.08 2.113 . . . . 14.54 105.744 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.82 133.63 92.12 Favored Pre-proline 0 C--N 1.311 -1.091 0 N-CA-C 108.336 -0.987 . . . . 19.35 108.336 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -44.62 -38.53 12.42 Favored 'Trans proline' 0 C--O 1.263 1.737 0 C-N-CA 123.543 2.828 . . . . 19.97 117.123 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 20.8 m -54.52 -32.28 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 122.538 2.426 . . . . 24.49 112.987 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -59.49 -29.48 67.87 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 127.337 2.898 . . . . 16.14 112.848 -177.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 98' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -63.34 -37.93 89.18 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 125.067 1.479 . . . . 18.05 109.704 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -62.61 -38.97 92.27 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.928 0.767 . . . . 47.64 109.967 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 50.8 mt -68.55 -41.71 79.41 Favored 'General case' 0 C--O 1.25 1.122 0 CA-C-O 116.966 -1.492 . . . . 14.73 111.906 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.55 -39.09 84.96 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 117.472 -1.691 . . . . 18.53 110.115 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m -54.52 -53.35 55.57 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 126.114 1.766 . . . . 18.46 112.027 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -56.65 -52.96 62.89 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 126.393 1.877 . . . . 18.43 107.996 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' SER . . . . . . . . . . . . . 31.4 m -51.92 -40.31 60.55 Favored 'General case' 0 C--O 1.252 1.202 0 O-C-N 124.847 1.342 . . . . 18.17 112.198 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 16.5 tp -70.5 -43.15 70.27 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 117.142 -1.409 . . . . 27.34 110.458 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.16 -44.08 92.12 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 125.727 1.892 . . . . 18.45 111.275 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 27.7 t -59.93 -35.72 62.48 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.22 0 C-N-CA 125.024 1.33 . . . . 18.65 109.707 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 108' ' ' THR . . . . . . . . . . . . . 87.9 m -70.14 -49.4 50.99 Favored 'General case' 0 C--O 1.246 0.914 0 O-C-N 125.795 1.934 . . . . 18.37 108.965 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 mt -60.05 -44.39 94.72 Favored 'General case' 0 C--N 1.311 -1.074 0 O-C-N 127.222 2.826 . . . . 21.54 110.374 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.19 -47.52 78.19 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 124.954 1.301 . . . . 18.63 113.569 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 2.7 p -69.33 -25.11 64.04 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 114.359 -1.291 . . . . 28.39 113.906 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' HIS . . . . . 0.424 ' C ' ' HD3' ' C' ' 114' ' ' PRO . 81.8 m-70 -98.92 -23.89 15.16 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 114.173 -2.822 . . . . 27.04 112.684 -179.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 113' ' ' LEU . . . . . 0.431 ' N ' ' HD3' ' C' ' 114' ' ' PRO . 5.5 mp -129.31 62.22 61.59 Favored Pre-proline 0 C--O 1.254 1.313 0 CA-C-N 121.411 1.914 . . . . 34.15 111.028 -178.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 114' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' C' ' 113' ' ' LEU . 25.5 Cg_exo -54.15 -35.01 80.96 Favored 'Trans proline' 0 C--O 1.252 1.198 0 O-C-N 123.85 1.447 . . . . 28.69 114.656 -176.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 115' ' ' SER . . . . . . . . . . . . . 33.7 m -85.8 -25.52 26.29 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 115.687 -2.101 . . . . 32.4 111.32 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -93.21 -17.24 23.93 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 114.19 -3.004 . . . . 35.45 112.531 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -82.1 61.49 5.39 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 127.72 3.138 . . . . 25.16 113.149 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' THR . . . . . . . . . . . . . 17.3 p -71.08 162.11 74.36 Favored Pre-proline 0 C--O 1.246 0.916 0 CA-C-N 114.308 -1.314 . . . . 22.04 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -53.46 -45.74 38.83 Favored 'Trans proline' 0 C--O 1.261 1.629 0 C-N-CA 120.838 1.025 . . . . 22.0 110.012 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.63 -32.96 74.82 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 117.652 -1.166 . . . . 19.26 112.983 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 t -73.48 -38.12 52.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 124.582 1.176 . . . . 22.61 109.453 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -54.08 -52.57 60.54 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-N 112.816 -1.993 . . . . 17.69 108.721 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.56 96.11 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 125.713 1.605 . . . . 14.66 113.317 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' SER . . . . . . . . . . . . . 68.0 m -72.0 -34.45 68.89 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 112.392 0.515 . . . . 19.14 112.392 178.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.72 -46.37 66.1 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 125.591 1.556 . . . . 16.72 108.341 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.89 -45.76 82.34 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 114.321 -1.309 . . . . 24.78 107.995 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -65.61 -40.38 92.58 Favored 'General case' 0 C--O 1.262 1.76 0 O-C-N 119.548 -1.97 . . . . 18.64 111.828 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.36 -49.02 75.52 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.061 -0.972 . . . . 14.66 109.766 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -39.0 89.6 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.874 -1.057 . . . . 17.6 109.537 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.15 99.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.378 1.561 . . . . 20.53 109.11 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -43.97 97.26 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.49 -1.232 . . . . 33.36 110.258 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 t -61.09 -44.82 99.06 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 C-N-CA 124.232 1.013 . . . . 15.88 108.739 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 53.7 m -60.07 -41.69 92.95 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.936 -1.029 . . . . 20.51 113.288 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 134' ' ' THR . . . . . . . . . . . . . 52.1 m -64.55 -42.78 95.46 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 113.886 -1.506 . . . . 17.29 111.993 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 135' ' ' VAL . . . . . . . . . . . . . 69.0 t -66.73 -44.02 89.71 Favored 'Isoleucine or valine' 0 C--O 1.252 1.227 0 O-C-N 126.408 2.318 . . . . 18.7 109.428 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 136' ' ' LEU . . . . . . . . . . . . . 14.6 mt -64.06 -26.4 68.54 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 120.154 1.343 . . . . 16.9 112.851 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 137' ' ' THR . . . . . . . . . . . . . 44.7 p -105.66 7.51 32.7 Favored 'General case' 0 C--O 1.247 0.949 0 C-N-CA 118.286 -1.365 . . . . 19.8 113.059 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 138' ' ' SER . . . . . . . . . . . . . 79.8 p -65.95 -19.86 66.01 Favored 'General case' 0 C--O 1.255 1.377 0 N-CA-C 115.948 1.833 . . . . 23.05 115.948 -177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 139' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -108.46 18.19 21.24 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 120.484 1.493 . . . . 30.92 112.432 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 140' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -65.38 -28.96 69.64 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 126.841 2.588 . . . . 19.98 114.075 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 141' ' ' ARG . . . . . 0.436 ' HG3' ' HD2' ' A' ' 127' ' ' LYS . 30.2 ptt180 . . . . . 0 C--O 1.26 1.643 0 CA-C-O 117.821 -1.085 . . . . 24.08 110.731 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 2' ' ' MET . . . . . . . . . . . . . 34.7 mtp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 119.356 -0.354 . . . . 61.45 111.811 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 83.4 mt -87.24 147.86 25.38 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 125.757 1.911 . . . . 53.11 108.879 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' THR . . . . . 0.623 ' OG1' ' HG3' ' D' ' 7' ' ' GLU . 58.7 p -83.62 162.46 20.79 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-N 112.614 -2.084 . . . . 50.79 108.674 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.71 -37.85 52.67 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 125.52 1.762 . . . . 50.39 109.349 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.06 -41.46 77.56 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 116.01 1.856 . . . . 63.09 116.01 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' GLU . . . . . 0.623 ' HG3' ' OG1' ' D' ' 4' ' ' THR . 55.2 mt-10 -66.72 -40.71 88.51 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 113.496 -1.684 . . . . 47.82 110.566 177.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -60.23 -51.16 70.74 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-O 123.634 1.683 . . . . 59.4 108.124 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.97 -48.22 82.32 Favored 'General case' 0 C--O 1.25 1.124 0 CA-C-N 114.319 -1.31 . . . . 33.94 109.176 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.97 81.21 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 115.52 1.674 . . . . 25.27 115.52 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.4 -38.79 27.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.9 0 C-N-CA 124.366 1.066 . . . . 26.72 111.166 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' THR . . . . . . . . . . . . . 24.5 m -64.65 -44.49 90.27 Favored 'General case' 0 C--O 1.249 1.041 0 CA-C-N 114.412 -1.267 . . . . 32.78 111.641 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.75 94.22 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-N 112.606 -2.088 . . . . 29.11 110.437 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -72.32 -38.05 68.77 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 125.37 1.669 . . . . 25.64 112.777 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -56.86 -35.06 68.43 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 114.533 -1.212 . . . . 28.98 111.191 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.74 16.66 0.14 Allowed Glycine 0 C--O 1.247 0.936 0 CA-C-O 117.646 -1.641 . . . . 35.04 114.424 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -126.79 -9.89 6.1 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 122.975 3.387 . . . . 40.23 109.911 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 11.9 t -80.11 133.11 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 127.888 3.242 . . . . 27.87 110.607 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.38 75.64 7.64 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 111.475 -2.602 . . . . 47.6 105.374 176.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -36.06 -48.48 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 128.969 2.908 . . . . 36.2 116.1 -178.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.56 -55.13 34.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 122.346 1.07 . . . . 50.26 111.317 -178.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.74 -49.42 76.63 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 114.369 1.248 . . . . 56.84 114.369 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.61 -43.04 96.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 126.708 2.003 . . . . 30.43 110.4 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.71 -49.19 81.21 Favored Glycine 0 C--O 1.249 1.04 0 C-N-CA 126.389 1.947 . . . . 24.07 111.207 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.11 91.45 Favored Glycine 0 N--CA 1.47 0.907 0 CA-C-O 123.58 1.656 . . . . 19.24 112.337 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.83 -49.57 61.48 Favored 'General case' 0 C--O 1.257 1.489 0 CA-C-N 113.585 -1.307 . . . . 27.12 110.186 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.03 -53.15 60.43 Favored 'General case' 0 C--O 1.257 1.451 0 O-C-N 126.241 2.213 . . . . 17.06 110.497 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.26 -38.63 90.02 Favored 'General case' 0 C--O 1.257 1.49 0 C-N-CA 118.29 -1.364 . . . . 17.53 111.571 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -47.06 86.94 Favored Glycine 0 CA--C 1.539 1.557 0 N-CA-C 110.134 -1.187 . . . . 16.9 110.134 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -63.18 -37.54 87.62 Favored 'General case' 0 C--O 1.257 1.487 0 CA-C-O 118.209 -0.901 . . . . 18.47 110.831 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' LEU . . . . . 0.578 HD22 HD23 ' D' ' 106' ' ' LEU . 14.2 tp -57.96 -44.4 87.0 Favored 'General case' 0 C--O 1.267 1.987 0 C-N-CA 125.78 1.632 . . . . 15.73 109.847 177.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.94 -26.08 62.14 Favored 'General case' 0 C--O 1.254 1.334 0 CA-C-O 117.954 -1.022 . . . . 18.49 113.153 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' VAL . . . . . . . . . . . . . 51.1 t -85.12 -50.16 14.95 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 O-C-N 126.114 2.134 . . . . 15.16 110.797 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 57.1 t -70.19 -38.2 73.96 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 O-C-N 125.531 1.769 . . . . 15.45 113.98 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -123.82 76.88 57.29 Favored Pre-proline 0 N--CA 1.479 1.021 0 N-CA-C 106.805 -1.554 . . . . 19.84 106.805 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.36 -22.45 33.74 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 O-C-N 126.366 2.772 . . . . 17.49 117.436 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -68.38 -17.07 64.15 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 120.046 1.294 . . . . 20.28 110.36 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' THR . . . . . . . . . . . . . 67.9 p -68.12 -19.8 64.86 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.004 0.921 . . . . 16.42 109.616 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -61.17 -20.32 62.59 Favored 'General case' 0 C--O 1.245 0.83 0 C-N-CA 124.657 1.183 . . . . 24.85 111.152 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -49.95 -34.8 21.85 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 126.023 2.077 . . . . 25.59 112.005 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -88.0 -5.78 58.33 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 122.573 2.442 . . . . 24.29 116.109 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -122.58 39.82 3.83 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.034 1.124 . . . . 30.18 114.034 -174.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.12 -42.35 98.37 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.485 -0.779 . . . . 54.61 110.702 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 44' ' ' SER . . . . . . . . . . . . . 78.7 p -64.49 -18.77 65.1 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 127.203 2.201 . . . . 43.27 113.07 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 45' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -65.19 -22.2 66.86 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 117.343 -1.313 . . . . 38.47 110.936 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 114.29 -135.12 12.19 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.214 0.946 . . . . 41.72 112.909 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -81.03 124.79 29.46 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.159 1.783 . . . . 50.99 111.799 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.92 11.15 3.36 Favored 'General case' 0 N--CA 1.482 1.167 1 O-C-N 129.237 4.086 . . . . 41.79 109.937 -177.231 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 66.0 p -56.19 -33.49 65.35 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 116.524 2.046 . . . . 46.22 116.524 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' THR . . . . . . . . . . . . . 28.6 p -129.46 166.26 19.96 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.47 -0.769 . . . . 38.85 112.52 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 51' ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' D' ' 55' ' ' MET . . . -58.49 -35.06 71.63 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 123.818 1.77 . . . . 32.1 110.642 178.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 52' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -73.61 -43.11 60.48 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.055 -1.429 . . . . 44.88 113.646 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.85 -48.69 80.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 125.418 1.699 . . . . 29.05 108.428 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 54' ' ' VAL . . . . . . . . . . . . . 46.9 t -60.8 -51.66 70.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 122.729 1.252 . . . . 25.33 111.648 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' MET . . . . . 0.576 ' HG2' ' O ' ' D' ' 51' ' ' ALA . 83.3 mmm -63.32 -39.95 95.97 Favored 'General case' 0 C--O 1.257 1.48 0 CA-C-O 118.424 -0.798 . . . . 32.61 112.114 -176.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 56' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -87.5 -9.93 53.17 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 116.66 -1.638 . . . . 43.99 113.598 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' ASN . . . . . 0.46 ' O ' ' HG3' ' D' ' 61' ' ' LYS . 22.0 t-20 -56.19 116.57 12.92 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-O 122.863 1.316 . . . . 30.5 111.222 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 58' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.31 -23.86 75.51 Favored 'Trans proline' 0 C--O 1.248 1.017 0 C-N-CA 123.395 2.73 . . . . 27.6 114.41 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -80.48 -37.22 32.2 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 125.632 1.832 . . . . 43.71 110.482 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.13 -46.84 93.95 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 CA-C-O 125.154 2.407 . . . . 23.88 108.116 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' LYS . . . . . 0.492 ' HE3' ' O ' ' D' ' 55' ' ' MET . 65.0 mttt -59.64 -47.34 85.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 111.44 -2.618 . . . . 51.79 111.806 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.5 -44.22 91.63 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.546 -0.752 . . . . 22.91 110.267 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -66.7 -39.06 87.91 Favored 'General case' 0 C--O 1.258 1.524 0 O-C-N 125.729 1.893 . . . . 24.63 111.534 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . -55.35 -44.42 84.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 114.051 -1.432 . . . . 22.78 112.577 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 tttp -64.58 -47.49 78.48 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 126.253 1.821 . . . . 42.37 109.554 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -55.33 -50.28 70.03 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 112.698 -2.046 . . . . 39.75 109.388 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' VAL . . . . . 0.418 HG13 ' C3B' ' D' ' 148' ' ' HEM . 69.3 t -61.08 -42.51 93.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 124.94 1.4 . . . . 20.15 111.574 179.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.73 -28.82 66.13 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 115.1 1.519 . . . . 27.06 115.1 -177.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -67.39 -42.73 82.88 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 123.933 1.825 . . . . 41.7 106.747 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' SER . . . . . . . . . . . . . 26.1 t -62.42 -43.6 98.42 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 112.365 -2.198 . . . . 26.43 108.213 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -55.44 -51.62 66.29 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 114.098 -1.41 . . . . 25.57 108.093 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' SER . . . . . 0.443 ' O ' ' HD2' ' D' ' 76' ' ' LYS . 69.2 m -54.26 -38.16 65.49 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 124.965 1.306 . . . . 26.88 111.589 178.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.86 -39.9 90.89 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 125.114 1.509 . . . . 47.94 109.598 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . -62.08 -37.81 95.07 Favored Glycine 0 N--CA 1.468 0.786 0 O-C-N 126.891 2.619 . . . . 31.97 110.204 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' MET . . . . . . . . . . . . . 90.3 mmm -59.87 -24.16 64.02 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 125.462 1.505 . . . . 32.19 112.843 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' D' ' 72' ' ' SER . 0.1 OUTLIER -87.82 -12.25 45.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 118.195 -0.907 . . . . 44.89 109.354 -179.775 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 77' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.93 44.99 2.78 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-O 116.464 -1.731 . . . . 46.14 114.487 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 24.5 mt -55.96 -23.35 31.69 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.792 1.308 . . . . 35.92 113.729 -177.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.32 -15.71 56.28 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 126.592 1.957 . . . . 56.84 112.807 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.65 71.26 0.98 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.014 -0.674 . . . . 44.71 110.479 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' LEU . . . . . . . . . . . . . 32.4 mt -68.52 -39.01 81.37 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 126.481 2.363 . . . . 32.6 108.171 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 25.9 mttp -58.62 -45.69 88.67 Favored 'General case' 0 C--O 1.249 1.046 0 O-C-N 125.873 1.983 . . . . 48.54 113.825 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.14 -45.45 61.94 Favored Glycine 0 N--CA 1.47 0.951 0 O-C-N 129.013 3.945 . . . . 30.43 109.227 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 33.6 m -59.68 -44.99 93.4 Favored 'General case' 0 C--O 1.254 1.29 0 N-CA-C 114.408 1.262 . . . . 28.87 114.408 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -99.0 0.71 44.44 Favored 'General case' 0 C--O 1.254 1.321 0 N-CA-C 116.498 2.036 . . . . 30.29 116.498 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -48.11 -50.28 29.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 120.444 1.475 . . . . 22.87 114.223 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.69 81.0 Favored 'General case' 0 C--O 1.25 1.107 0 O-C-N 120.605 -1.309 . . . . 21.1 112.42 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mt -68.99 -34.17 74.86 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 117.806 -1.093 . . . . 22.16 111.537 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 44.2 t -57.06 -55.8 30.02 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 127.485 2.991 . . . . 16.04 107.263 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -55.02 -48.01 73.94 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.303 2.252 . . . . 49.65 111.974 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' LEU . . . . . . . . . . . . . 3.6 tp -61.41 -42.6 98.98 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 113.823 -1.535 . . . . 24.19 111.531 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -67.36 -31.3 71.46 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 125.423 1.702 . . . . 16.56 109.818 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.76 -62.94 1.53 Allowed 'General case' 0 C--O 1.244 0.777 0 O-C-N 124.183 0.927 . . . . 17.35 111.028 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -69.23 -43.87 73.18 Favored 'General case' 0 C--O 1.255 1.343 0 N-CA-C 116.907 2.188 . . . . 32.99 116.907 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' D' ' 95' ' ' LYS . 9.1 mptt -98.22 -38.33 9.34 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 117.835 -1.546 . . . . 43.98 113.667 -178.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 85.8 mt -88.59 -26.48 21.92 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.998 1.481 . . . . 21.73 114.998 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 58.43 43.0 20.32 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 125.055 1.472 . . . . 27.42 110.656 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -88.85 117.13 31.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 C-N-CA 124.72 1.208 . . . . 16.28 110.961 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -59.09 122.92 66.73 Favored Pre-proline 0 C--O 1.255 1.378 0 N-CA-C 104.609 -2.367 . . . . 15.77 104.609 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 100' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.18 -24.77 51.91 Favored 'Trans proline' 0 C--N 1.325 -0.658 0 C-N-CA 123.32 2.68 . . . . 12.26 112.586 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tp10 -54.12 -32.52 55.32 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 121.063 -1.023 . . . . 32.23 110.122 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -58.74 -36.95 75.15 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 120.151 -1.593 . . . . 25.73 112.303 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -61.17 -36.26 79.34 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 106.697 -1.594 . . . . 14.96 106.697 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -70.36 -45.14 66.68 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 126.482 2.364 . . . . 37.52 109.133 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 23.4 mt -59.49 -41.35 89.61 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 124.222 0.951 . . . . 15.98 111.814 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' LEU . . . . . 0.578 HD23 HD22 ' D' ' 31' ' ' LEU . 3.0 tm? -69.61 -39.42 77.23 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 115.747 -0.661 . . . . 19.02 110.508 -176.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 107' ' ' GLY . . . . . 0.799 ' HA3' HG13 ' D' ' 134' ' ' VAL . . . -59.21 -45.11 95.86 Favored Glycine 0 N--CA 1.48 1.617 0 N-CA-C 108.122 -1.991 . . . . 18.96 108.122 178.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 108' ' ' ASN . . . . . 0.454 ' O ' HG22 ' D' ' 111' ' ' VAL . 77.5 m-20 -65.85 -45.35 82.5 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 120.738 -1.448 . . . . 34.56 112.818 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 109' ' ' VAL . . . . . . . . . . . . . 35.0 t -60.44 -39.69 81.88 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 CA-C-O 123.09 1.424 . . . . 16.34 109.536 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 22.5 tp -64.54 -41.81 96.12 Favored 'General case' 0 C--O 1.252 1.203 0 O-C-N 119.628 -1.92 . . . . 17.48 108.678 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' VAL . . . . . 0.454 HG22 ' O ' ' D' ' 108' ' ' ASN . 28.2 m -65.97 -34.16 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 107.376 -1.342 . . . . 20.89 107.376 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 112' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.75 -36.37 75.68 Favored 'Isoleucine or valine' 0 C--O 1.254 1.317 0 CA-C-N 119.161 0.891 . . . . 20.29 110.679 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 5.1 t -71.07 -40.32 75.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 O-C-N 126.511 2.382 . . . . 18.46 107.626 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' LEU . . . . . . . . . . . . . 30.9 mt -60.08 -43.15 95.69 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 123.477 1.608 . . . . 20.81 108.697 179.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.79 -48.69 80.67 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.589 1.185 . . . . 22.73 111.335 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 116' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -27.58 69.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-N 114.505 -1.225 . . . . 38.48 113.248 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 117' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -90.44 -28.74 18.41 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 114.662 -2.59 . . . . 29.58 113.089 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -108.95 -2.02 18.6 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 115.072 1.508 . . . . 29.56 115.072 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.72 -130.71 5.14 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.446 -1.062 . . . . 28.85 110.446 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.01 -19.0 27.73 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 116.274 -1.822 . . . . 49.27 114.618 -176.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 121' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -70.86 -25.03 62.63 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 125.96 2.037 . . . . 46.58 112.16 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -87.83 75.26 8.91 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 127.078 2.736 . . . . 31.29 107.331 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' THR . . . . . . . . . . . . . 29.9 p -69.49 159.85 81.83 Favored Pre-proline 0 C--N 1.314 -0.959 0 N-CA-C 117.552 2.427 . . . . 26.17 117.552 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.55 -40.89 45.68 Favored 'Trans proline' 0 C--O 1.259 1.565 0 O-C-N 123.423 1.223 . . . . 25.83 111.684 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 91.0 t -70.26 -39.0 76.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 120.853 -1.155 . . . . 25.55 111.987 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 126' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' D' ' 126' ' ' LEU . 1.9 tp -62.91 -53.42 54.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.042 -1.435 . . . . 30.86 107.666 -179.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -52.48 -43.0 64.74 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 125.718 1.886 . . . . 27.81 111.288 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.08 -42.8 95.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.74 1.275 . . . . 22.17 109.509 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.22 -45.33 93.83 Favored 'General case' 0 C--N 1.314 -0.957 0 O-C-N 126.435 2.335 . . . . 32.61 110.503 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -67.03 -34.71 78.31 Favored 'General case' 0 C--O 1.248 1.015 0 O-C-N 125.013 1.445 . . . . 37.75 111.127 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 131' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -59.7 -37.91 80.12 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 126.874 2.609 . . . . 26.28 107.39 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -69.65 -39.41 77.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.988 -1.006 . . . . 30.53 111.407 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' VAL . . . . . . . . . . . . . 37.4 t -63.54 -55.58 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.787 1.28 . . . . 18.19 110.852 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 134' ' ' VAL . . . . . 0.799 HG13 ' HA3' ' D' ' 107' ' ' GLY 0.306 2.3 t -51.34 -40.42 23.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 CA-C-N 112.099 -2.319 . . . . 17.69 111.932 179.058 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.35 -50.16 48.89 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.676 1.59 . . . . 15.92 108.72 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 136' ' ' GLY . . . . . . . . . . . . . . . -61.24 -36.51 92.54 Favored Glycine 0 N--CA 1.478 1.436 0 CA-C-O 118.05 -1.417 . . . . 18.56 110.328 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 137' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.28 -49.27 62.5 Favored 'Isoleucine or valine' 0 C--O 1.25 1.091 0 CA-C-N 119.75 1.775 . . . . 16.67 110.564 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.2 -39.63 69.85 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.259 1.028 . . . . 17.95 109.315 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 139' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -69.9 -42.43 73.39 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 114.874 -2.489 . . . . 49.61 111.362 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.37 -38.47 90.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 127.647 3.092 . . . . 21.29 108.974 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 141' ' ' LEU . . . . . . . . . . . . . 13.1 mt -69.88 -24.46 63.42 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.84 1.422 . . . . 20.27 114.84 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.02 -8.44 33.61 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 125.785 2.707 . . . . 25.77 116.58 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . 0.317 1.6 t-80 -63.74 -24.36 67.74 Favored 'General case' 0 C--O 1.261 1.673 0 CA-C-N 112.149 -2.296 . . . . 50.94 116.342 -174.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 144' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -104.33 12.57 33.39 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-N 121.386 1.903 . . . . 56.23 111.695 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 145' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -68.44 144.91 54.52 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 105.715 -1.957 . . . . 24.06 105.715 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' HIS . . . . . . . . . . . . . 34.5 p80 . . . . . 0 C--O 1.262 1.732 0 CA-C-O 114.002 -2.904 . . . . 36.49 108.305 -178.646 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 148' ' ' HEM . . . . . 0.593 ' HHC' HBB2 ' B' ' 148' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 143' ' ' HEM . . . . . 0.465 HBB2 ' CMB' ' C' ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 148' ' ' HEM . . . . . 0.418 ' C3B' HG13 ' D' ' 67' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 752' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 759' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 762' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 769' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 770' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 771' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 772' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 773' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 776' ' ' HOH . . . . . 0.695 ' O ' ' OD1' ' A' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 781' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 782' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 786' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 788' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 789' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 790' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 751' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 753' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 754' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 763' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 766' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 775' ' ' HOH . . . . . 0.412 ' O ' ' HB3' ' B' ' 143' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 777' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 783' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 756' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 761' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 774' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 778' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 779' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 780' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 784' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 787' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 791' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 792' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 760' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 768' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 793' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 794' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.258 1.504 0 CA-C-O 117.699 -1.144 . . . . 45.9 109.917 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.25 123.9 27.86 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.751 3.157 . . . . 37.25 112.048 -179.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.7 p -80.8 173.61 12.43 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 117.099 -1.841 . . . . 28.88 107.445 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -61.37 -41.67 97.47 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.269 -1.382 . . . . 24.58 107.269 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.08 -43.55 95.4 Favored 'General case' 0 C--O 1.243 0.762 0 O-C-N 126.416 2.322 . . . . 22.59 112.644 179.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.42 ' OD2' ' HE2' ' A' ' 127' ' ' LYS . 78.6 m-20 -59.5 -48.97 79.6 Favored 'General case' 0 C--O 1.246 0.897 0 O-C-N 127.189 2.806 . . . . 17.84 109.086 179.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 65.1 mttt -57.79 -43.98 85.99 Favored 'General case' 0 C--O 1.265 1.882 0 O-C-N 125.319 1.637 . . . . 26.58 111.663 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.94 -43.87 98.6 Favored Glycine 0 CA--C 1.542 1.735 0 CA-C-O 125.21 2.561 . . . . 17.19 111.317 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -58.95 -46.07 88.94 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 117.622 -3.281 . . . . 21.85 110.456 179.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.8 t -67.51 -44.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 O-C-N 126.01 2.068 . . . . 15.96 109.589 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.9 mttp -59.87 -45.48 92.34 Favored 'General case' 0 C--N 1.316 -0.868 0 O-C-N 125.169 1.543 . . . . 36.16 108.921 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.98 -53.29 57.69 Favored 'General case' 0 C--N 1.315 -0.927 0 O-C-N 121.38 -0.825 . . . . 19.26 112.283 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.35 99.02 Favored 'General case' 0 C--O 1.247 0.934 0 O-C-N 124.48 1.113 . . . . 21.02 111.522 -178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -67.0 -30.49 70.61 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 122.082 0.944 . . . . 24.73 109.03 -178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -63.76 -32.48 84.32 Favored Glycine 0 N--CA 1.469 0.873 0 CA-C-N 113.807 -1.542 . . . . 26.61 110.007 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.79 -24.88 44.34 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.191 -1.182 . . . . 55.34 111.213 -179.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -68.67 -47.22 77.76 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 124.497 2.094 . . . . 28.39 105.447 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 43.54 -120.26 2.89 Favored Glycine 0 C--N 1.319 -0.416 0 CA-C-N 112.717 -2.038 . . . . 31.23 111.888 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.35 -16.34 54.04 Favored Glycine 0 C--O 1.248 1.007 0 C-N-CA 126.496 1.998 . . . . 30.68 117.381 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -86.64 -3.79 59.08 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-O 116.127 -1.892 . . . . 42.05 115.653 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -45.98 -55.73 6.44 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 128.169 3.418 . . . . 20.37 112.024 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.37 -42.8 78.41 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.282 0.633 . . . . 16.8 111.007 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -63.33 -44.22 95.55 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 117.818 -1.087 . . . . 46.64 113.204 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -66.95 -31.45 72.03 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 126.615 2.447 . . . . 24.99 110.12 -178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.7 -47.21 88.69 Favored Glycine 0 CA--C 1.531 1.053 0 O-C-N 125.588 1.805 . . . . 15.22 109.639 179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.12 -40.6 82.46 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 112.393 -1.904 . . . . 14.82 107.915 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -70.44 -39.15 74.54 Favored 'General case' 0 C--N 1.317 -0.81 0 O-C-N 123.576 0.547 . . . . 20.19 111.793 178.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -60.16 -42.02 94.02 Favored 'General case' 0 C--O 1.256 1.411 0 O-C-N 119.779 -1.826 . . . . 10.06 110.265 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 53.3 mt -60.91 -49.53 77.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 114.204 -1.362 . . . . 11.87 110.584 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -58.84 -41.07 86.08 Favored 'General case' 0 C--O 1.254 1.313 0 O-C-N 125.146 1.529 . . . . 40.71 109.778 -179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.6 mtt-85 -67.44 -39.23 85.41 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.437 -0.949 . . . . 16.39 108.437 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 52.6 ttp -60.68 -44.51 96.4 Favored 'General case' 0 C--O 1.249 1.062 0 CA-C-O 123.003 1.382 . . . . 12.26 111.294 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -64.01 -38.89 92.71 Favored 'General case' 0 C--O 1.252 1.194 0 CA-C-O 117.412 -1.28 . . . . 14.91 111.711 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.6 mt -76.32 -46.2 28.77 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 126.679 2.487 . . . . 24.56 113.76 -178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . 0.43 ' HB3' ' HG3' ' B' ' 131' ' ' GLN . 4.7 m -75.85 -30.49 58.95 Favored 'General case' 0 C--O 1.248 0.998 0 CA-C-O 115.543 -2.17 . . . . 22.62 111.934 -177.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -131.56 79.21 69.6 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 126.532 2.395 . . . . 16.63 110.805 -178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -57.24 -26.33 69.44 Favored 'Trans proline' 0 C--N 1.32 -0.94 0 C-N-CA 123.291 2.661 . . . . 14.94 115.109 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -61.88 -19.31 62.5 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 119.147 0.885 . . . . 12.21 112.535 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 p -69.3 -21.51 63.86 Favored 'General case' 0 C--O 1.257 1.477 0 CA-C-O 121.214 0.53 . . . . 11.82 111.318 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -67.79 -18.05 64.73 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 117.194 -1.384 . . . . 16.8 112.171 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 44.1 p -65.99 -15.33 62.92 Favored 'General case' 0 C--O 1.256 1.423 0 O-C-N 125.754 1.908 . . . . 14.6 111.595 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -91.38 -5.29 54.71 Favored 'General case' 0 C--O 1.254 1.299 0 O-C-N 125.066 1.478 . . . . 16.09 113.431 178.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.76 58.13 34.04 Favored Pre-proline 0 N--CA 1.482 1.167 0 O-C-N 124.736 1.272 . . . . 18.72 110.278 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -67.0 -18.9 52.19 Favored 'Trans proline' 0 C--O 1.243 0.75 0 CA-C-O 116.203 -1.665 . . . . 21.3 113.423 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -114.76 25.62 10.82 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.173 1.546 . . . . 38.87 115.173 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -104.62 145.86 29.73 Favored 'General case' 0 C--N 1.321 -0.665 0 O-C-N 128.607 3.692 . . . . 23.04 107.499 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -87.66 107.45 18.63 Favored 'General case' 0 C--N 1.31 -1.109 1 N-CA-C 97.912 -4.848 . . . . 36.13 97.912 171.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.3 mt -97.07 9.88 40.87 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 125.097 1.498 . . . . 30.11 113.445 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 78.6 p -61.91 151.67 34.12 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 106.907 -1.516 . . . . 30.64 106.907 179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -58.03 128.89 39.4 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 114.441 -1.254 . . . . 47.16 107.844 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 85.89 0.14 87.57 Favored Glycine 0 C--O 1.25 1.122 0 N-CA-C 117.296 1.679 . . . . 28.98 117.296 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.95 142.49 24.48 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 119.395 1.598 . . . . 26.56 112.166 -179.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.93 73.34 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.427 1.091 . . . . 21.12 110.912 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -64.18 -47.22 80.65 Favored 'General case' 0 C--N 1.313 -1.003 0 C-N-CA 124.155 0.982 . . . . 27.65 111.157 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 94.2 t -69.31 -37.32 75.53 Favored 'Isoleucine or valine' 0 C--O 1.248 1.018 0 O-C-N 123.522 0.514 . . . . 19.86 110.314 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.0 mttp -65.91 -42.76 89.76 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.373 -0.831 . . . . 44.96 108.898 178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.7 -41.36 95.91 Favored Glycine 0 CA--C 1.526 0.741 0 N-CA-C 110.292 -1.123 . . . . 14.95 110.292 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -71.81 -37.94 70.28 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-O 121.214 0.531 . . . . 19.03 110.654 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -60.52 -34.76 87.04 Favored Glycine 0 N--CA 1.469 0.861 0 CA-C-O 123.981 1.878 . . . . 14.33 110.51 179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.64 -37.69 65.25 Favored 'General case' 0 C--O 1.26 1.656 0 CA-C-N 113.916 -1.142 . . . . 17.38 110.554 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -69.08 -42.05 76.72 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 125.308 1.63 . . . . 34.84 110.098 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.29 -47.59 91.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 N-CA-C 107.716 -1.216 . . . . 11.21 107.716 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.11 -36.99 78.67 Favored 'General case' 0 C--O 1.254 1.318 0 O-C-N 124.498 1.123 . . . . 12.06 113.684 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.31 -35.03 71.13 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 125.424 1.702 . . . . 10.54 110.15 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.45 97.83 Favored 'General case' 0 C--O 1.253 1.265 0 O-C-N 120.99 -1.069 . . . . 11.87 108.93 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 66.3 mt -64.32 -40.02 95.07 Favored 'General case' 0 C--O 1.248 1.026 0 O-C-N 124.747 1.279 . . . . 15.32 110.019 179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 98.8 m -60.29 -41.25 92.97 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 114.987 -1.006 . . . . 16.68 108.755 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -66.76 -34.4 77.75 Favored 'General case' 0 C--O 1.246 0.903 0 CA-C-O 123.23 1.49 . . . . 36.26 108.867 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.55 -49.94 71.45 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 107.952 -1.129 . . . . 14.86 107.952 178.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.406 ' HA ' HD13 ' A' ' 73' ' ' LEU . 31.1 t -55.95 -32.57 33.29 Favored 'Isoleucine or valine' 0 C--O 1.245 0.858 0 CA-C-O 121.875 0.845 . . . . 21.19 112.741 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.85 -17.48 57.33 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 116.428 2.01 . . . . 52.11 116.428 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -130.93 49.66 2.3 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 126.929 2.092 . . . . 32.07 110.039 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -59.93 -21.89 61.72 Favored 'General case' 0 C--O 1.256 1.399 0 O-C-N 126.223 2.202 . . . . 27.02 111.393 -177.807 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -94.69 2.44 55.57 Favored 'General case' 0 C--O 1.244 0.786 0 C-N-CA 124.581 1.153 . . . . 28.74 111.904 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -152.16 56.0 0.83 Allowed 'General case' 0 C--N 1.315 -0.921 0 O-C-N 120.484 -1.385 . . . . 20.14 112.216 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.46 ' N ' ' CD ' ' A' ' 77' ' ' PRO . 0.0 OUTLIER -57.07 -46.76 99.83 Favored Pre-proline 0 C--N 1.309 -1.155 0 O-C-N 126.085 2.115 . . . . 25.2 110.063 -179.09 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.46 ' CD ' ' N ' ' A' ' 76' ' ' LEU . 44.9 Cg_exo -59.77 -35.21 95.04 Favored 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.909 3.072 . . . . 20.44 114.06 -179.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -80.58 -44.43 8.55 Favored Glycine 0 C--O 1.246 0.872 0 N-CA-C 108.377 -1.889 . . . . 21.06 108.377 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.39 -32.47 73.29 Favored 'General case' 0 C--O 1.264 1.85 0 N-CA-C 113.235 0.828 . . . . 26.69 113.235 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.5 mt -113.02 22.94 13.88 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.231 -2.795 . . . . 25.2 115.166 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 37.1 p -60.68 -48.32 82.32 Favored 'General case' 0 C--O 1.252 1.189 0 CA-C-O 114.658 -2.592 . . . . 32.88 112.519 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.57 -44.83 85.58 Favored 'General case' 0 C--O 1.256 1.434 0 O-C-N 127.139 2.775 . . . . 58.54 110.383 -179.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.4 mt -67.45 -26.26 66.31 Favored 'General case' 0 C--O 1.248 1.016 0 CA-C-O 112.948 -3.406 . . . . 24.86 112.431 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 15.5 m -72.23 -41.58 66.7 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 127.384 2.927 . . . . 24.27 109.085 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -60.34 -50.69 72.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 111.014 -2.812 . . . . 33.51 107.505 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 46.0 tp -60.11 -51.36 69.93 Favored 'General case' 0 C--O 1.259 1.592 0 O-C-N 126.929 2.643 . . . . 17.49 111.729 -178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 91' ' ' LEU . 66.5 m80 -64.82 -40.74 95.68 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 117.7 -1.6 . . . . 15.87 112.776 -179.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.58 -45.09 84.6 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 116.086 1.884 . . . . 17.96 116.086 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 m-70 -98.74 -24.8 14.89 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 119.01 2.967 . . . . 35.42 119.01 -175.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -113.5 -64.06 1.36 Allowed 'General case' 0 C--O 1.248 1.0 0 O-C-N 124.362 1.039 . . . . 44.42 113.236 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 87' ' ' HIS . 80.0 mt -60.19 -49.55 77.18 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 125.183 1.393 . . . . 19.14 114.114 -177.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 48.95 56.15 8.19 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 126.952 2.657 . . . . 29.61 113.831 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 61.5 t -82.15 124.24 38.98 Favored 'Isoleucine or valine' 0 C--O 1.25 1.125 0 CA-C-N 111.338 -2.665 . . . . 14.03 108.081 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -54.84 132.87 66.39 Favored Pre-proline 0 N--CA 1.48 1.058 0 O-C-N 124.894 1.371 . . . . 23.33 109.742 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -47.2 -29.55 9.38 Favored 'Trans proline' 0 C--O 1.262 1.695 0 C-N-CA 124.614 3.542 . . . . 18.21 118.528 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 22.8 m -62.5 -31.83 53.23 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 CA-C-N 119.802 1.183 . . . . 23.94 111.821 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -63.0 -24.27 67.84 Favored 'General case' 0 C--O 1.247 0.968 0 CA-C-O 113.63 -3.081 . . . . 18.13 112.854 -177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -64.35 -38.53 91.35 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 128.614 3.696 . . . . 15.34 110.598 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -65.39 -36.99 85.64 Favored 'General case' 0 C--N 1.311 -1.096 0 O-C-N 125.731 1.895 . . . . 48.89 110.526 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 48.2 mt -65.71 -39.83 91.62 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 125.082 1.489 . . . . 12.62 112.424 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.06 -39.67 65.71 Favored 'General case' 0 C--O 1.241 0.627 0 O-C-N 120.916 -1.115 . . . . 9.65 109.81 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 68.2 m -57.35 -50.5 72.75 Favored 'General case' 0 C--O 1.242 0.66 0 N-CA-C 109.533 -0.543 . . . . 11.72 109.533 179.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.59 -47.81 81.09 Favored 'General case' 0 C--O 1.262 1.737 0 O-C-N 125.693 1.871 . . . . 11.65 110.878 179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 67.8 m -60.41 -36.51 78.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.306 1.042 . . . . 15.97 110.701 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 tp -70.19 -38.44 75.36 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 113.81 -1.541 . . . . 30.72 111.382 178.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.21 -45.48 91.49 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 124.835 1.254 . . . . 13.89 108.209 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 66.8 t -60.54 -46.54 95.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 114.852 -1.067 . . . . 11.45 109.263 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.7 m -59.67 -52.18 66.61 Favored 'General case' 0 C--N 1.315 -0.904 0 O-C-N 123.682 0.614 . . . . 12.28 110.745 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.0 -47.62 80.41 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 124.423 1.077 . . . . 14.3 111.237 -179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -57.3 -43.95 83.65 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 117.402 -1.285 . . . . 18.46 110.993 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 42.0 p -70.11 -25.47 63.51 Favored 'General case' 0 C--O 1.246 0.894 0 O-C-N 124.807 1.317 . . . . 20.83 111.157 -176.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -93.58 -22.47 18.79 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 114.458 1.281 . . . . 21.39 114.458 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.05 63.05 65.26 Favored Pre-proline 0 C--O 1.249 1.072 0 CA-C-N 119.215 0.916 . . . . 25.32 110.477 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -53.88 -42.48 66.23 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 O-C-N 124.078 1.567 . . . . 19.15 115.945 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 10.5 m -74.26 -31.24 62.48 Favored 'General case' 0 C--N 1.306 -1.294 0 C-N-CA 126.176 1.79 . . . . 31.04 112.722 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.695 ' OD1' ' O ' ' A' ' 776' ' ' HOH . 3.6 m-20 -91.25 -18.94 23.57 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 114.777 1.399 . . . . 32.95 114.777 -178.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -80.97 66.41 6.48 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 125.617 2.627 . . . . 20.43 111.792 -179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.6 p -78.47 163.13 63.22 Favored Pre-proline 0 C--O 1.252 1.217 0 CA-C-N 113.376 -1.738 . . . . 12.75 108.4 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -47.71 -47.12 19.23 Favored 'Trans proline' 0 C--O 1.252 1.22 0 C-N-CA 121.853 1.702 . . . . 12.42 110.363 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.41 96.94 Favored 'General case' 0 C--O 1.255 1.368 0 CA-C-O 117.405 -1.284 . . . . 12.79 112.555 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 23.5 t -66.69 -40.16 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 CA-C-O 123.962 1.839 . . . . 12.67 111.828 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 6.2 t-160 -54.07 -53.83 47.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 124.133 1.92 . . . . 14.45 108.9 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.24 -42.63 86.77 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.527 -1.358 . . . . 14.22 111.486 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.4 m -69.14 -40.94 77.93 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 117.695 -1.145 . . . . 14.11 111.426 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 53.0 mt -66.68 -42.79 85.94 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 124.974 1.421 . . . . 11.8 109.886 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -56.86 -46.33 81.87 Favored 'General case' 0 C--O 1.241 0.619 0 O-C-N 125.197 1.561 . . . . 19.72 107.461 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.436 ' HD2' ' HG3' ' C' ' 141' ' ' ARG . 0.5 OUTLIER -65.79 -41.28 92.17 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 124.377 1.048 . . . . 19.88 111.827 179.826 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -59.65 -49.31 78.24 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 124.392 1.057 . . . . 10.13 109.064 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 50.9 mt -62.46 -40.6 97.14 Favored 'General case' 0 C--O 1.252 1.237 0 C-N-CA 117.604 -1.639 . . . . 9.3 110.651 -178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.63 -41.31 90.17 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 119.7 -0.8 . . . . 12.39 108.846 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -68.76 -33.07 73.28 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 122.299 1.047 . . . . 34.47 110.717 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.62 -42.82 77.97 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 N-CA-C 107.364 -1.347 . . . . 11.96 107.364 177.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 39.9 m -57.2 -46.79 82.55 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 126.122 2.868 . . . . 15.34 114.269 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.6 m -59.21 -43.87 92.28 Favored 'General case' 0 C--O 1.257 1.476 0 C-N-CA 126.305 1.842 . . . . 14.89 111.366 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 9.5 t -64.7 -44.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 O-C-N 125.701 1.876 . . . . 12.85 110.372 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -62.33 -31.87 72.56 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 127.087 2.155 . . . . 13.6 113.466 -178.183 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 66.1 p -105.74 13.08 30.21 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 112.576 0.584 . . . . 17.45 112.576 178.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 79.1 p -71.63 -16.66 62.28 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 117.475 2.398 . . . . 18.36 117.475 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -106.32 7.22 31.18 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 127.006 2.122 . . . . 33.62 111.997 -179.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.17 -37.54 77.61 Favored 'General case' 0 C--O 1.249 1.039 0 O-C-N 125.624 1.828 . . . . 21.12 114.856 -178.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 33.4 ptt180 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 116.152 -1.88 . . . . 27.6 111.846 -179.982 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' MET . . . . . 0.588 ' HE3' ' HG ' ' B' ' 3' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.238 0.479 0 CA-C-O 121.241 0.543 . . . . 61.28 111.599 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.588 ' HG ' ' HE3' ' B' ' 2' ' ' MET . 0.2 OUTLIER -69.82 171.11 9.77 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 129.362 3.065 . . . . 50.43 110.991 179.86 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . 0.455 ' OG1' ' HG2' ' B' ' 6' ' ' GLU . 4.8 p -81.31 167.7 19.23 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 113.007 -1.906 . . . . 39.72 109.259 177.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.22 -31.52 72.07 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 115.384 -0.825 . . . . 32.11 113.053 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.455 ' HG2' ' OG1' ' B' ' 4' ' ' THR . 0.6 OUTLIER -77.54 -36.28 52.42 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.751 1.221 . . . . 41.25 111.771 177.365 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -70.16 -43.46 70.81 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.996 1.435 . . . . 34.58 107.24 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.97 -44.28 91.49 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 124.232 1.967 . . . . 49.67 108.271 179.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.81 99.37 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-N 114.365 -1.288 . . . . 23.15 110.236 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.14 -48.0 75.1 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 125.691 1.596 . . . . 19.66 114.39 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -65.08 -44.77 95.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 CA-C-N 114.611 -1.177 . . . . 18.25 108.604 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -56.46 -51.93 66.58 Favored 'General case' 0 C--O 1.249 1.058 0 CA-C-O 122.958 1.361 . . . . 26.29 111.526 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.15 -44.06 97.91 Favored 'General case' 0 C--O 1.25 1.121 0 CA-C-N 111.403 -2.635 . . . . 25.49 111.542 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.55 -45.96 81.34 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-O 120.737 0.303 . . . . 29.66 110.476 179.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 64.7 t-105 -56.16 -35.44 67.2 Favored 'General case' 0 C--O 1.25 1.108 0 CA-C-N 115.855 -0.611 . . . . 24.77 111.932 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.19 -12.87 18.38 Favored Glycine 0 N--CA 1.469 0.871 0 CA-C-O 119.232 -0.76 . . . . 30.14 112.937 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.679 ' HE3' ' OE2' ' B' ' 121' ' ' GLU . 31.5 mttm -97.08 -9.61 27.68 Favored 'General case' 0 C--O 1.247 0.952 0 C-N-CA 126.434 1.894 . . . . 49.77 113.441 179.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -76.66 130.21 36.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 O-C-N 124.406 1.066 . . . . 30.84 113.495 -177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' CD ' ' B' ' 22' ' ' GLU . 2.6 mtpp -91.8 89.98 7.3 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 103.289 -2.856 . . . . 42.47 103.289 176.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 3.4 t -55.8 -40.14 59.91 Favored 'Isoleucine or valine' 0 C--O 1.263 1.789 0 N-CA-C 117.064 2.246 . . . . 30.89 117.064 -174.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.58 -41.56 88.34 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 120.249 1.386 . . . . 47.35 110.696 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.428 ' CD ' ' HE3' ' B' ' 19' ' ' LYS . 90.5 mt-10 -66.35 -54.25 26.81 Favored 'General case' 0 N--CA 1.447 -0.591 0 O-C-N 126.228 2.205 . . . . 47.39 115.205 179.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.68 -37.1 79.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 113.05 -1.887 . . . . 22.89 108.971 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 68' ' ' LEU . . . -60.25 -57.1 20.9 Favored Glycine 0 C--O 1.255 1.438 0 C-N-CA 126.061 1.791 . . . . 18.03 112.013 179.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -61.68 -41.26 99.57 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 108.483 -1.847 . . . . 17.19 108.483 -179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -62.37 -50.94 69.56 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 116.99 -1.481 . . . . 21.82 111.04 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.05 -54.38 47.77 Favored 'General case' 0 C--O 1.253 1.242 0 O-C-N 126.354 2.284 . . . . 15.18 110.105 -179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.05 -45.88 89.64 Favored 'General case' 0 C--O 1.253 1.258 0 O-C-N 124.505 1.128 . . . . 13.96 112.099 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -58.58 -50.12 70.27 Favored Glycine 0 C--O 1.254 1.349 0 N-CA-C 108.888 -1.685 . . . . 14.25 108.888 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 54.6 mtt-85 -61.28 -37.1 81.97 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 117.882 0.841 . . . . 13.26 112.033 -178.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 12.7 tp -57.45 -47.41 81.91 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.357 1.661 . . . . 12.41 110.086 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.32 -24.57 65.76 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.13 1.159 . . . . 18.59 114.13 -178.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 55.3 t -87.26 -48.06 15.56 Favored 'Isoleucine or valine' 0 C--O 1.247 0.942 0 CA-C-O 117.097 -1.43 . . . . 15.7 111.462 -178.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 57.3 t -74.64 -32.74 29.96 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.099 0 CA-C-O 114.525 -2.655 . . . . 15.56 113.646 -177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -126.76 74.94 75.58 Favored Pre-proline 0 C--N 1.304 -1.406 0 C-N-CA 127.781 2.432 . . . . 25.29 106.155 178.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -55.62 -26.22 54.29 Favored 'Trans proline' 0 C--O 1.253 1.272 0 N-CA-C 116.5 1.692 . . . . 18.5 116.5 -175.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.421 ' HA ' ' HG2' ' C' ' 92' ' ' ARG . 46.7 p90 -62.36 -18.83 62.51 Favored 'General case' 0 C--O 1.245 0.858 0 CA-C-N 121.322 1.874 . . . . 18.93 110.692 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 57.9 p -70.65 -14.62 62.54 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 120.007 1.276 . . . . 17.21 111.495 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -61.43 -22.85 65.4 Favored 'General case' 0 C--O 1.25 1.104 0 CA-C-N 112.491 -2.141 . . . . 21.73 111.266 178.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -50.65 -30.38 13.37 Favored 'General case' 0 C--O 1.253 1.287 0 O-C-N 124.937 1.398 . . . . 27.28 113.258 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.08 -9.07 52.53 Favored 'General case' 0 C--O 1.243 0.751 0 CA-C-O 116.256 -1.83 . . . . 20.41 115.4 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -122.27 30.39 6.58 Favored 'General case' 0 C--N 1.315 -0.908 0 O-C-N 125.34 1.65 . . . . 25.3 114.231 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -55.65 -34.54 65.06 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 122.281 1.038 . . . . 51.02 111.743 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 92.9 p -70.2 -19.09 63.19 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-N 114.668 -1.151 . . . . 33.89 112.634 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -65.5 -16.41 63.63 Favored 'General case' 0 C--O 1.25 1.128 0 CA-C-O 117.053 -1.451 . . . . 31.37 111.445 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 112.65 -147.39 18.37 Favored Glycine 0 N--CA 1.477 1.375 0 C-N-CA 118.206 -1.949 . . . . 33.17 110.08 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -73.09 118.2 15.75 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.744 -1.228 . . . . 47.5 113.748 -178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 67.5 mt -129.09 19.46 5.94 Favored 'General case' 0 C--N 1.307 -1.241 0 O-C-N 125.958 2.037 . . . . 36.36 111.384 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 73.1 p -65.71 -31.83 73.05 Favored 'General case' 0 C--O 1.259 1.6 0 N-CA-C 118.508 2.781 . . . . 45.24 118.508 -176.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 19.4 p -129.23 162.02 28.82 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.818 -0.808 . . . . 36.89 108.818 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' B' ' 55' ' ' MET . . . -51.99 -49.34 63.5 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.137 0.575 . . . . 30.89 110.102 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -57.45 -46.77 83.24 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 125.622 1.826 . . . . 50.17 112.981 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 57' ' ' ASN . . . -56.67 -43.74 80.71 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 123.974 1.845 . . . . 28.49 110.563 179.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 77.7 t -66.75 -53.0 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.598 -1.183 . . . . 26.06 110.809 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' B' ' 51' ' ' ALA . 87.3 mmm -64.1 -35.05 79.48 Favored 'General case' 0 C--O 1.249 1.07 0 CA-C-O 116.864 -1.541 . . . . 26.98 111.696 -176.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -90.31 -4.6 57.02 Favored 'General case' 0 C--O 1.251 1.157 0 O-C-N 124.422 1.076 . . . . 35.48 113.057 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 53' ' ' ALA . 20.0 t-20 -64.35 119.09 53.36 Favored Pre-proline 0 N--CA 1.473 0.676 0 O-C-N 123.662 0.601 . . . . 25.23 110.927 -178.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -61.17 -33.11 91.23 Favored 'Trans proline' 0 C--N 1.321 -0.915 0 C-N-CA 122.71 2.273 . . . . 24.09 114.845 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -77.65 -31.83 52.93 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 124.749 1.281 . . . . 47.09 110.586 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 3.2 t -65.84 -39.52 84.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 125.09 2.376 . . . . 24.96 107.345 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -55.95 27.61 Favored 'General case' 0 C--O 1.251 1.176 0 CA-C-N 112.51 -2.132 . . . . 51.99 111.985 179.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.41 -47.45 86.05 Favored 'General case' 0 C--O 1.256 1.405 0 CA-C-N 114.758 -1.11 . . . . 20.04 110.856 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 39.5 t60 -63.01 -41.68 99.63 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 113.975 -1.466 . . . . 19.0 111.406 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -57.38 -43.47 93.84 Favored Glycine 0 N--CA 1.471 1.001 0 N-CA-C 109.462 -1.455 . . . . 15.55 109.462 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 49.7 tttp -58.62 -48.13 82.05 Favored 'General case' 0 C--O 1.247 0.955 0 C-N-CA 124.227 1.011 . . . . 35.98 110.76 178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -57.45 -50.39 73.18 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-N 113.128 -1.851 . . . . 26.68 112.508 179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . 0.424 HG13 ' C3B' ' B' ' 148' ' ' HEM . 59.8 t -60.9 -45.38 98.35 Favored 'Isoleucine or valine' 0 C--O 1.255 1.365 0 CA-C-N 115.553 -0.749 . . . . 17.22 111.0 -178.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.545 HD12 ' HB3' ' B' ' 71' ' ' PHE . 1.7 tp -71.4 -31.12 66.9 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 125.382 1.676 . . . . 19.04 113.265 -179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 83.3 m-20 -64.54 -37.9 89.17 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 106.501 -1.666 . . . . 34.32 106.501 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -68.1 -43.65 78.0 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 126.066 2.104 . . . . 16.92 107.991 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PHE . . . . . 0.545 ' HB3' HD12 ' B' ' 68' ' ' LEU . 39.4 t80 -58.54 -45.1 89.6 Favored 'General case' 0 C--O 1.261 1.66 0 O-C-N 124.883 1.365 . . . . 18.95 110.019 176.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 57.5 m -55.0 -34.42 63.4 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 123.288 1.518 . . . . 22.47 113.148 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -62.65 -38.47 90.42 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 113.078 -1.874 . . . . 39.77 108.022 178.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.77 -34.73 83.75 Favored Glycine 0 N--CA 1.478 1.482 0 CA-C-N 113.39 -1.732 . . . . 23.79 110.117 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 92.8 mmm -60.05 -21.65 61.68 Favored 'General case' 0 C--O 1.247 0.937 0 O-C-N 126.437 1.904 . . . . 27.59 110.337 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.36 -11.33 46.52 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 125.42 1.7 . . . . 46.13 109.041 179.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -130.92 40.33 3.49 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 120.807 1.639 . . . . 39.9 115.033 -177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 14.8 mt -48.2 -18.7 0.22 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 114.609 1.337 . . . . 33.38 114.609 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -89.39 -31.45 17.75 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 115.271 -2.3 . . . . 49.01 111.276 -179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -130.43 68.31 1.47 Allowed 'General case' 0 C--O 1.247 0.969 0 O-C-N 126.013 2.071 . . . . 36.03 109.81 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 61.6 mt -67.72 -39.13 84.35 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 125.876 1.985 . . . . 25.72 109.948 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -56.42 -51.73 67.3 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.546 1.138 . . . . 48.3 111.389 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.29 -43.74 96.51 Favored Glycine 0 N--CA 1.473 1.104 0 O-C-N 126.483 2.365 . . . . 21.96 108.461 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 28.2 m -56.16 -45.6 79.63 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 116.381 -1.771 . . . . 21.35 114.389 -178.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -101.19 11.62 39.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 126.653 2.471 . . . . 24.19 114.656 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -54.33 -48.69 71.09 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 113.078 0.77 . . . . 19.25 113.078 179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.55 91.15 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.275 0.984 . . . . 19.74 111.138 -179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 11.5 mt -72.63 -28.45 62.76 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 116.729 -1.605 . . . . 19.2 111.814 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 28.4 t -65.34 -48.97 71.16 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 125.527 2.584 . . . . 17.82 107.42 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -53.64 -46.69 70.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 110.744 -2.935 . . . . 49.77 110.119 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.15 -46.24 81.7 Favored 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.163 0.915 . . . . 23.35 112.869 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -61.93 -32.27 72.67 Favored 'General case' 0 C--O 1.253 1.289 0 CA-C-O 122.877 1.323 . . . . 15.02 112.11 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.93 -63.7 1.35 Allowed 'General case' 0 C--O 1.257 1.48 0 CA-C-N 114.978 -1.01 . . . . 16.68 113.222 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -67.94 -45.37 74.47 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-O 113.699 -3.048 . . . . 33.51 114.725 -176.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' B' ' 95' ' ' LYS . 0.6 OUTLIER -95.22 -46.18 6.87 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 127.42 2.95 . . . . 40.21 114.56 179.692 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 29.5 mt -90.31 -16.35 29.43 Favored 'General case' 0 C--O 1.245 0.865 0 CA-C-O 114.116 -2.849 . . . . 21.5 114.494 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HIS . . . . . . . . . . . . . 35.1 m-70 52.48 45.31 28.79 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 123.488 2.858 . . . . 26.22 114.569 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 69.4 t -92.04 120.23 40.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 113.958 -1.474 . . . . 15.05 109.554 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' B' ' 100' ' ' PRO . 44.6 t0 -64.29 128.44 93.23 Favored Pre-proline 0 C--N 1.308 -1.234 0 N-CA-C 105.471 -2.048 . . . . 14.99 105.471 175.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 99' ' ' ASP . 4.1 Cg_exo -62.37 -14.42 38.74 Favored 'Trans proline' 0 C--N 1.322 -0.837 0 C-N-CA 124.088 3.192 . . . . 12.21 114.392 -179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -58.06 -33.85 69.47 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.132 -1.062 . . . . 30.23 108.132 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -59.0 -36.18 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 129.474 3.11 . . . . 19.01 110.929 178.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -65.16 -35.16 80.23 Favored 'General case' 0 C--O 1.249 1.068 0 CA-C-O 116.776 -1.583 . . . . 20.04 109.381 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 32.5 mttt -71.94 -41.68 67.53 Favored 'General case' 0 C--O 1.253 1.285 0 O-C-N 125.393 1.683 . . . . 35.71 111.175 178.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 24.2 mt -58.96 -51.31 70.61 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.507 -1.224 . . . . 19.12 107.852 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.16 -37.34 84.86 Favored 'General case' 0 C--O 1.255 1.39 0 O-C-N 124.125 0.891 . . . . 12.19 111.53 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -61.35 -41.63 99.57 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 118.888 -1.625 . . . . 14.88 109.862 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 55.2 m-20 -69.94 -37.84 75.98 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.452 -1.261 . . . . 29.14 111.679 -178.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 17.8 t -67.67 -36.05 74.79 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 O-C-N 125.585 1.803 . . . . 13.53 110.072 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 58.1 tp -59.47 -44.21 93.06 Favored 'General case' 0 C--O 1.249 1.076 0 CA-C-N 113.405 -1.725 . . . . 10.87 108.884 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 55.1 t -61.74 -42.88 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 O-C-N 124.862 1.351 . . . . 14.56 111.7 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 47.2 t -62.35 -41.17 90.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 122.781 0.432 . . . . 13.16 110.182 178.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 6.2 t -62.67 -43.27 98.45 Favored 'Isoleucine or valine' 0 C--O 1.246 0.875 0 O-C-N 120.919 -1.113 . . . . 9.98 112.798 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 80.3 mt -61.44 -41.07 96.62 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.539 1.161 . . . . 15.65 108.732 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -66.98 -42.12 85.64 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.374 -1.285 . . . . 14.93 107.59 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -63.65 -46.2 86.74 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 119.772 -1.83 . . . . 18.75 110.928 -178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -70.86 -32.31 69.27 Favored 'General case' 0 C--O 1.257 1.459 0 CA-C-O 115.295 -2.288 . . . . 23.2 115.907 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -108.7 0.06 20.34 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.045 1.498 . . . . 31.95 115.045 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 49.84 -128.01 24.64 Favored Glycine 0 C--N 1.302 -1.337 0 O-C-N 125.263 1.602 . . . . 23.94 111.949 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -26.26 68.01 Favored 'General case' 0 C--O 1.25 1.129 0 O-C-N 127.435 2.491 . . . . 51.71 113.793 -177.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLU . . . . . 0.679 ' OE2' ' HE3' ' B' ' 17' ' ' LYS . 52.9 tt0 -63.37 -29.11 70.47 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 122.939 1.352 . . . . 50.21 110.596 178.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -86.88 81.11 8.25 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 126.512 3.053 . . . . 24.08 105.62 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . . . . . . . . . 43.6 p -72.18 160.66 82.13 Favored Pre-proline 0 C--O 1.25 1.081 0 CA-C-N 113.159 -1.837 . . . . 21.31 111.405 -179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.92 -36.85 92.96 Favored 'Trans proline' 0 C--O 1.257 1.426 0 CA-C-N 112.081 -1.792 . . . . 19.5 110.017 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 26.2 t -69.74 -42.64 80.25 Favored 'Isoleucine or valine' 0 C--O 1.245 0.86 0 CA-C-O 121.837 0.827 . . . . 21.25 111.545 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.459 HD12 ' HA ' ' B' ' 126' ' ' LEU . 4.3 tp -63.35 -45.64 90.27 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 112.514 -2.13 . . . . 29.61 106.973 178.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -57.98 -43.39 86.48 Favored 'General case' 0 C--O 1.256 1.441 0 O-C-N 121.648 -0.657 . . . . 16.51 110.643 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.25 -44.68 84.11 Favored 'General case' 0 C--O 1.246 0.895 0 O-C-N 125.14 1.525 . . . . 17.92 110.174 -179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 78.0 m-20 -59.97 -43.6 94.96 Favored 'General case' 0 C--O 1.25 1.098 0 CA-C-O 115.829 -2.034 . . . . 26.15 112.09 179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PHE . . . . . 0.443 ' O ' HG13 ' B' ' 134' ' ' VAL . 10.6 m-85 -69.35 -32.61 71.78 Favored 'General case' 0 C--O 1.259 1.584 0 O-C-N 127.916 3.26 . . . . 20.35 113.517 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.43 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 1.5 mm100 -60.56 -42.52 96.77 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 107.941 -1.133 . . . . 20.31 107.941 176.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 32.6 mttt -65.71 -38.19 88.51 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.09 -0.959 . . . . 37.07 108.723 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.92 -52.61 37.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 124.565 1.165 . . . . 17.82 112.502 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' VAL . . . . . 0.443 HG13 ' O ' ' B' ' 130' ' ' PHE . 3.6 m -60.24 -35.57 62.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 O-C-N 123.922 0.764 . . . . 12.87 108.969 -178.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.6 -41.34 84.21 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.724 -0.843 . . . . 15.5 108.724 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -62.19 -45.5 95.9 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 108.249 -1.94 . . . . 15.63 108.249 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . . 59.2 t -64.86 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 C-N-CA 119.689 -0.804 . . . . 16.23 112.456 -179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.48 88.3 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.771 0.828 . . . . 19.53 110.577 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -67.72 -37.69 82.58 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 124.498 1.124 . . . . 47.84 111.417 178.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.95 -47.01 76.07 Favored 'General case' 0 C--O 1.248 1.017 0 O-C-N 124.939 1.4 . . . . 19.97 107.249 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . . 16.0 mt -67.11 -23.19 65.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 115.479 1.659 . . . . 19.62 115.479 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -87.94 -20.14 26.31 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 127.317 2.247 . . . . 18.87 113.25 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' B' ' 775' ' ' HOH . 55.3 t-80 -53.35 -45.51 69.17 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 117.963 2.579 . . . . 49.07 117.963 -175.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -88.22 15.26 7.83 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 123.69 2.95 . . . . 60.15 114.191 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -75.14 147.07 40.82 Favored 'General case' 0 C--O 1.241 0.651 0 N-CA-C 107.76 -1.2 . . . . 24.22 107.76 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . . 21.7 p80 . . . . . 0 C--O 1.264 1.824 0 O-C-N 126.644 2.465 . . . . 31.83 112.216 -178.026 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' VAL . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.242 0.669 0 CA-C-O 125.039 2.352 . . . . 47.53 110.009 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 29.5 mt -78.29 121.59 24.63 Favored 'General case' 0 C--O 1.25 1.105 0 CA-C-N 110.485 -3.052 . . . . 38.65 108.867 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' SER . . . . . . . . . . . . . 87.1 p -78.71 175.69 10.2 Favored 'General case' 0 C--O 1.255 1.345 0 N-CA-C 107.059 -1.46 . . . . 33.96 107.059 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.69 -43.09 94.2 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 126.79 2.556 . . . . 27.69 108.882 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.16 -34.17 76.98 Favored 'General case' 0 C--O 1.254 1.308 0 CA-C-N 113.156 -1.838 . . . . 24.81 111.691 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -63.63 -46.74 84.32 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 125.981 2.051 . . . . 22.28 110.671 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -58.93 -46.56 87.67 Favored 'General case' 0 C--O 1.259 1.6 1 O-C-N 129.662 4.351 . . . . 30.16 111.047 -178.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.73 -48.28 82.81 Favored Glycine 0 C--O 1.248 1.018 0 CA-C-N 113.465 -1.698 . . . . 23.51 110.191 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -61.58 -41.34 97.27 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 113.011 0.745 . . . . 27.29 113.011 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 14.7 t -64.99 -49.4 79.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 O-C-N 125.927 2.017 . . . . 21.67 109.601 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -60.27 -46.8 88.54 Favored 'General case' 0 C--O 1.25 1.119 0 O-C-N 126.654 2.471 . . . . 32.63 109.952 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.06 -50.1 74.69 Favored 'General case' 0 C--O 1.258 1.542 0 C-N-CA 119.274 -0.97 . . . . 24.89 111.838 178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.57 -36.14 83.25 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 114.072 1.138 . . . . 22.11 114.072 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -69.53 -32.73 71.73 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 122.95 1.357 . . . . 29.08 108.563 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLY . . . . . . . . . . . . . . . -58.67 -48.6 83.98 Favored Glycine 0 CA--C 1.548 2.1 0 CA-C-N 113.045 -1.889 . . . . 32.43 108.523 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -66.96 -32.69 74.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 117.232 -1.366 . . . . 54.04 109.771 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' VAL . . . . . . . . . . . . . 27.1 t -57.3 -47.93 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 105.919 -1.882 . . . . 29.73 105.919 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 52.84 -131.19 40.4 Favored Glycine 0 C--O 1.251 1.194 0 O-C-N 126.095 2.122 . . . . 32.78 110.867 -179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.17 -14.45 59.34 Favored Glycine 0 C--O 1.254 1.4 0 N-CA-C 118.158 2.023 . . . . 32.35 118.158 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.45 1.34 33.65 Favored 'General case' 0 C--O 1.257 1.472 0 N-CA-C 114.689 1.366 . . . . 36.73 114.689 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.91 -50.17 61.62 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 126.209 2.193 . . . . 25.04 111.833 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.9 -44.07 82.0 Favored 'General case' 0 C--O 1.244 0.791 0 CA-C-O 122.489 1.138 . . . . 20.05 111.112 -179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -61.18 -48.03 83.45 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 112.943 -1.935 . . . . 52.03 112.706 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -64.47 -36.14 83.22 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.735 0.814 . . . . 25.84 112.291 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' GLY . . . . . . . . . . . . . . . -63.9 -46.55 91.32 Favored Glycine 0 C--O 1.255 1.456 0 N-CA-C 107.351 -2.299 . . . . 18.73 107.351 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.83 -36.38 84.15 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 118.818 -1.153 . . . . 18.84 110.843 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 75.7 tt0 -69.84 -37.74 76.28 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.468 0.307 . . . . 30.33 110.57 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.07 -48.02 83.66 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.649 -1.612 . . . . 15.74 106.649 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 37.9 mt -54.24 -50.11 67.95 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 125.354 1.658 . . . . 22.0 114.117 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' GLU . . . . . 0.409 ' OE2' ' HD2' ' C' ' 50' ' ' HIS . 86.4 tt0 -59.83 -44.33 94.11 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 113.46 -1.7 . . . . 46.45 112.096 179.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 67.4 mtt-85 -62.06 -44.86 95.77 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 125.738 1.899 . . . . 24.16 108.437 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.65 -46.9 80.77 Favored 'General case' 0 C--O 1.264 1.822 0 C-N-CA 127.284 2.234 . . . . 17.23 111.527 176.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -65.86 -34.9 79.2 Favored 'General case' 0 C--O 1.258 1.537 0 CA-C-O 116.402 -1.761 . . . . 22.61 115.369 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . . 34.2 mt -77.89 -44.76 26.12 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.039 1.462 . . . . 27.62 112.833 179.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 1.5 m -68.38 -47.73 66.58 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 126.588 2.43 . . . . 19.88 113.081 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' PHE . . . . . . . . . . . . . 32.7 m-85 -122.09 77.14 41.7 Favored Pre-proline 0 C--O 1.253 1.244 0 C-N-CA 124.24 1.016 . . . . 18.91 111.662 -178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -50.29 -27.39 17.77 Favored 'Trans proline' 0 C--O 1.253 1.228 0 C-N-CA 123.783 2.989 . . . . 18.69 116.126 -176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' THR . . . . . . . . . . . . . 60.4 p -62.67 -23.78 67.29 Favored 'General case' 0 C--O 1.256 1.428 0 C-N-CA 124.274 1.03 . . . . 17.3 112.081 178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 79.1 p -68.33 -18.53 64.52 Favored 'General case' 0 C--O 1.247 0.922 0 O-C-N 124.06 0.85 . . . . 12.96 110.699 -179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -72.5 -17.76 61.72 Favored 'General case' 0 C--O 1.251 1.143 0 O-C-N 124.918 1.386 . . . . 19.03 112.003 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' THR . . . . . . . . . . . . . 28.6 p -61.93 -18.46 60.39 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 116.716 -1.611 . . . . 15.3 111.351 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -89.49 -6.84 56.07 Favored 'General case' 0 C--O 1.255 1.382 0 N-CA-C 114.287 1.217 . . . . 17.31 114.287 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -125.97 49.01 3.27 Favored Pre-proline 0 N--CA 1.486 1.359 0 N-CA-C 113.249 0.833 . . . . 22.19 113.249 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -61.13 -30.77 89.58 Favored 'Trans proline' 0 C--N 1.313 -1.308 0 C-N-CA 123.508 2.805 . . . . 26.93 114.632 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' HIS . . . . . 0.52 ' ND1' ' N ' ' C' ' 45' ' ' HIS . 14.0 p-80 -93.95 17.77 11.69 Favored 'General case' 0 C--O 1.255 1.392 0 O-C-N 120.78 -1.2 . . . . 37.47 111.681 -179.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -108.72 156.07 20.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.626 -1.25 . . . . 26.49 107.626 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -93.64 109.45 21.08 Favored 'General case' 0 C--O 1.247 0.959 1 N-CA-C 98.749 -4.537 . . . . 40.64 98.749 173.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.14 16.02 24.1 Favored 'General case' 0 C--O 1.244 0.786 0 O-C-N 125.373 1.67 . . . . 32.77 113.873 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' SER . . . . . . . . . . . . . 70.9 p -67.33 163.43 20.66 Favored 'General case' 0 C--O 1.247 0.945 0 O-C-N 125.27 1.606 . . . . 38.35 109.238 -179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' HIS . . . . . 0.409 ' HD2' ' OE2' ' C' ' 30' ' ' GLU . 17.3 t-80 -61.93 131.84 51.04 Favored 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.942 1.401 . . . . 42.69 107.364 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLY . . . . . 0.741 ' HA2' ' NZ ' ' C' ' 56' ' ' LYS . . . 72.6 11.36 77.03 Favored Glycine 0 C--O 1.258 1.64 0 N-CA-C 119.434 2.533 . . . . 33.22 119.434 179.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.8 142.4 35.01 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 125.041 1.083 . . . . 30.06 108.511 178.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.91 -40.52 93.44 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 125.642 1.577 . . . . 26.12 110.813 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -58.05 -48.19 80.84 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 112.854 -1.976 . . . . 28.57 110.579 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' VAL . . . . . . . . . . . . . 78.6 t -66.22 -46.01 88.52 Favored 'Isoleucine or valine' 0 C--O 1.248 1.019 0 O-C-N 125.592 1.808 . . . . 23.6 108.823 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LYS . . . . . 0.741 ' NZ ' ' HA2' ' C' ' 51' ' ' GLY . 1.3 mtpp -62.48 -38.02 88.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 117.844 -1.542 . . . . 54.59 111.107 178.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' GLY . . . . . . . . . . . . . . . -63.86 -46.88 90.57 Favored Glycine 0 N--CA 1.475 1.282 0 N-CA-C 110.701 -0.96 . . . . 19.87 110.701 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -66.97 -42.65 84.8 Favored 'General case' 0 C--O 1.256 1.398 0 O-C-N 126.282 1.813 . . . . 22.75 112.206 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . -56.93 -37.13 76.77 Favored Glycine 0 C--O 1.27 2.385 0 O-C-N 119.161 -2.212 . . . . 18.34 111.459 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.25 -35.88 76.57 Favored 'General case' 0 C--O 1.252 1.235 0 CA-C-O 118.233 -0.889 . . . . 16.2 110.429 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' LYS . . . . . . . . . . . . . 12.3 mttp -71.7 -37.62 70.65 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 124.827 1.329 . . . . 33.11 111.446 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.09 -52.18 62.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 113.968 -1.469 . . . . 11.1 109.213 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.57 88.32 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 111.362 -2.654 . . . . 12.24 110.877 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.17 -38.59 83.65 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 108.769 -0.826 . . . . 11.45 108.769 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.2 86.52 Favored 'General case' 0 N--CA 1.5 2.027 0 C-N-CA 118.524 -1.27 . . . . 13.48 110.746 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 mt -60.62 -38.93 86.38 Favored 'General case' 0 C--O 1.256 1.447 0 CA-C-N 115.361 -0.836 . . . . 17.84 110.202 179.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -62.15 -41.45 98.31 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.071 -0.968 . . . . 20.22 109.283 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.89 -48.76 79.04 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 124.612 1.195 . . . . 46.47 109.71 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.68 -47.15 70.72 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.33 1.452 . . . . 24.29 111.836 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' VAL . . . . . . . . . . . . . 97.7 t -60.51 -31.58 49.2 Favored 'Isoleucine or valine' 0 C--O 1.249 1.074 0 C-N-CA 125.32 1.448 . . . . 24.86 112.15 178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . 0.257 25.4 mt-10 -79.0 -25.93 43.32 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 118.18 -0.914 . . . . 57.18 109.111 179.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -119.66 52.69 1.09 Allowed 'General case' 0 C--N 1.317 -0.819 0 O-C-N 124.548 1.155 . . . . 43.48 110.772 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' C' ' 73' ' ' LEU . 16.5 mt -61.31 -31.54 71.39 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 124.882 1.364 . . . . 30.0 110.398 -178.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -80.23 10.24 4.72 Favored 'General case' 0 C--O 1.252 1.225 0 O-C-N 125.133 1.521 . . . . 46.91 112.903 -178.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -167.03 60.23 0.08 Allowed 'General case' 0 C--O 1.25 1.098 0 CA-C-N 118.68 0.673 . . . . 35.67 111.462 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' LEU . . . . . 0.631 ' N ' ' CD ' ' C' ' 77' ' ' PRO . 0.0 OUTLIER -56.87 -40.23 83.56 Favored Pre-proline 0 C--O 1.251 1.161 0 CA-C-N 113.896 -1.502 . . . . 26.72 111.756 -179.309 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' PRO . . . . . 0.631 ' CD ' ' N ' ' C' ' 76' ' ' LEU . 44.1 Cg_exo -59.4 -39.55 75.6 Favored 'Trans proline' 0 C--O 1.254 1.286 0 C-N-CA 122.473 2.115 . . . . 25.66 113.427 -178.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.86 -42.25 13.21 Favored Glycine 0 N--CA 1.484 1.887 0 CA-C-O 124.635 2.242 . . . . 23.75 109.64 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.88 -35.72 73.46 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 113.387 -1.407 . . . . 25.26 111.194 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 77.7 mt -109.31 14.27 23.82 Favored 'General case' 0 C--O 1.25 1.114 0 CA-C-O 114.785 -2.531 . . . . 23.48 116.192 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' C' ' 84' ' ' SER . 13.8 p -50.46 -53.86 26.46 Favored 'General case' 0 C--O 1.256 1.416 0 CA-C-O 115.595 -2.145 . . . . 32.25 112.626 -177.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -66.86 -31.79 72.62 Favored 'General case' 0 C--O 1.26 1.631 0 CA-C-O 115.48 -2.2 . . . . 49.08 115.337 -179.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 83.6 mt -71.63 -23.52 61.71 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 115.525 -2.178 . . . . 18.86 108.363 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' C' ' 81' ' ' SER . 3.2 m -66.93 -49.39 65.65 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 126.255 2.222 . . . . 20.15 109.088 178.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -64.62 -41.92 95.85 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 126.572 2.42 . . . . 34.49 108.65 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' LEU . . . . . . . . . . . . . 20.4 tp -64.18 -43.47 95.02 Favored 'General case' 0 C--O 1.262 1.753 0 N-CA-C 113.451 0.908 . . . . 21.55 113.451 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -69.71 -43.79 71.7 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 117.197 -1.801 . . . . 18.65 109.569 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.55 -47.61 75.28 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 116.194 1.924 . . . . 16.04 116.194 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' HIS . . . . . . . . . . . . . 35.0 m-70 -95.27 -25.85 16.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 113.682 -3.056 . . . . 35.91 117.45 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' LYS . . . . . . . . . . . . . 69.2 tttt -113.63 -60.47 1.88 Allowed 'General case' 0 C--N 1.317 -0.825 0 O-C-N 128.477 3.611 . . . . 39.37 115.055 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' LEU . . . . . . . . . . . . . 59.4 mt -67.83 -45.71 73.89 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 119.787 1.176 . . . . 18.47 112.518 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' ARG . . . . . 0.421 ' HG2' ' HA ' ' B' ' 37' ' ' TRP . 3.0 mpp_? 51.17 55.27 9.77 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 125.245 1.418 . . . . 31.55 113.065 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' VAL . . . . . . . . . . . . . 53.2 t -79.49 127.85 38.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 O-C-N 126.08 2.113 . . . . 14.54 105.744 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -60.82 133.63 92.12 Favored Pre-proline 0 C--N 1.311 -1.091 0 N-CA-C 108.336 -0.987 . . . . 19.35 108.336 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -44.62 -38.53 12.42 Favored 'Trans proline' 0 C--O 1.263 1.737 0 C-N-CA 123.543 2.828 . . . . 19.97 117.123 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 20.8 m -54.52 -32.28 24.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 CA-C-N 122.538 2.426 . . . . 24.49 112.987 -179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -59.49 -29.48 67.87 Favored 'General case' 0 C--O 1.245 0.868 0 O-C-N 127.337 2.898 . . . . 16.14 112.848 -177.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -63.34 -37.93 89.18 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 125.067 1.479 . . . . 18.05 109.704 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' LYS . . . . . . . . . . . . . 7.6 mptt -62.61 -38.97 92.27 Favored 'General case' 0 C--N 1.323 -0.582 0 O-C-N 123.928 0.767 . . . . 47.64 109.967 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' LEU . . . . . . . . . . . . . 50.8 mt -68.55 -41.71 79.41 Favored 'General case' 0 C--O 1.25 1.122 0 CA-C-O 116.966 -1.492 . . . . 14.73 111.906 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 42.3 tp -67.55 -39.09 84.96 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 117.472 -1.691 . . . . 18.53 110.115 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 18.6 m -54.52 -53.35 55.57 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 126.114 1.766 . . . . 18.46 112.027 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -56.65 -52.96 62.89 Favored 'General case' 0 C--N 1.311 -1.068 0 C-N-CA 126.393 1.877 . . . . 18.43 107.996 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' SER . . . . . . . . . . . . . 31.4 m -51.92 -40.31 60.55 Favored 'General case' 0 C--O 1.252 1.202 0 O-C-N 124.847 1.342 . . . . 18.17 112.198 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' LEU . . . . . . . . . . . . . 16.5 tp -70.5 -43.15 70.27 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 117.142 -1.409 . . . . 27.34 110.458 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.16 -44.08 92.12 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 125.727 1.892 . . . . 18.45 111.275 179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' VAL . . . . . . . . . . . . . 27.7 t -59.93 -35.72 62.48 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.22 0 C-N-CA 125.024 1.33 . . . . 18.65 109.707 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' THR . . . . . . . . . . . . . 87.9 m -70.14 -49.4 50.99 Favored 'General case' 0 C--O 1.246 0.914 0 O-C-N 125.795 1.934 . . . . 18.37 108.965 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' LEU . . . . . . . . . . . . . 51.3 mt -60.05 -44.39 94.72 Favored 'General case' 0 C--N 1.311 -1.074 0 O-C-N 127.222 2.826 . . . . 21.54 110.374 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' ALA . . . . . . . . . . . . . . . -56.19 -47.52 78.19 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 124.954 1.301 . . . . 18.63 113.569 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' SER . . . . . . . . . . . . . 2.7 p -69.33 -25.11 64.04 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 114.359 -1.291 . . . . 28.39 113.906 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' HIS . . . . . 0.424 ' C ' ' HD3' ' C' ' 114' ' ' PRO . 81.8 m-70 -98.92 -23.89 15.16 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 114.173 -2.822 . . . . 27.04 112.684 -179.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' LEU . . . . . 0.431 ' N ' ' HD3' ' C' ' 114' ' ' PRO . 5.5 mp -129.31 62.22 61.59 Favored Pre-proline 0 C--O 1.254 1.313 0 CA-C-N 121.411 1.914 . . . . 34.15 111.028 -178.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' C' ' 113' ' ' LEU . 25.5 Cg_exo -54.15 -35.01 80.96 Favored 'Trans proline' 0 C--O 1.252 1.198 0 O-C-N 123.85 1.447 . . . . 28.69 114.656 -176.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' SER . . . . . . . . . . . . . 33.7 m -85.8 -25.52 26.29 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 115.687 -2.101 . . . . 32.4 111.32 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -93.21 -17.24 23.93 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 114.19 -3.004 . . . . 35.45 112.531 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -82.1 61.49 5.39 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 127.72 3.138 . . . . 25.16 113.149 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' THR . . . . . . . . . . . . . 17.3 p -71.08 162.11 74.36 Favored Pre-proline 0 C--O 1.246 0.916 0 CA-C-N 114.308 -1.314 . . . . 22.04 108.318 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -53.46 -45.74 38.83 Favored 'Trans proline' 0 C--O 1.261 1.629 0 C-N-CA 120.838 1.025 . . . . 22.0 110.012 177.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.63 -32.96 74.82 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 117.652 -1.166 . . . . 19.26 112.983 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 t -73.48 -38.12 52.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 124.582 1.176 . . . . 22.61 109.453 178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -54.08 -52.57 60.54 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-N 112.816 -1.993 . . . . 17.69 108.721 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.56 96.11 Favored 'General case' 0 C--O 1.252 1.221 0 C-N-CA 125.713 1.605 . . . . 14.66 113.317 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' SER . . . . . . . . . . . . . 68.0 m -72.0 -34.45 68.89 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 112.392 0.515 . . . . 19.14 112.392 178.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.72 -46.37 66.1 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 125.591 1.556 . . . . 16.72 108.341 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.89 -45.76 82.34 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 114.321 -1.309 . . . . 24.78 107.995 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -65.61 -40.38 92.58 Favored 'General case' 0 C--O 1.262 1.76 0 O-C-N 119.548 -1.97 . . . . 18.64 111.828 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.36 -49.02 75.52 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.061 -0.972 . . . . 14.66 109.766 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.57 -39.0 89.6 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.874 -1.057 . . . . 17.6 109.537 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.07 -43.15 99.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 123.378 1.561 . . . . 20.53 109.11 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.74 -43.97 97.26 Favored 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.49 -1.232 . . . . 33.36 110.258 -179.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' VAL . . . . . . . . . . . . . 14.9 t -61.09 -44.82 99.06 Favored 'Isoleucine or valine' 0 C--O 1.246 0.88 0 C-N-CA 124.232 1.013 . . . . 15.88 108.739 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' SER . . . . . . . . . . . . . 53.7 m -60.07 -41.69 92.95 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.936 -1.029 . . . . 20.51 113.288 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' THR . . . . . . . . . . . . . 52.1 m -64.55 -42.78 95.46 Favored 'General case' 0 C--O 1.25 1.111 0 CA-C-N 113.886 -1.506 . . . . 17.29 111.993 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' VAL . . . . . . . . . . . . . 69.0 t -66.73 -44.02 89.71 Favored 'Isoleucine or valine' 0 C--O 1.252 1.227 0 O-C-N 126.408 2.318 . . . . 18.7 109.428 177.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' LEU . . . . . . . . . . . . . 14.6 mt -64.06 -26.4 68.54 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 120.154 1.343 . . . . 16.9 112.851 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' THR . . . . . . . . . . . . . 44.7 p -105.66 7.51 32.7 Favored 'General case' 0 C--O 1.247 0.949 0 C-N-CA 118.286 -1.365 . . . . 19.8 113.059 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' SER . . . . . . . . . . . . . 79.8 p -65.95 -19.86 66.01 Favored 'General case' 0 C--O 1.255 1.377 0 N-CA-C 115.948 1.833 . . . . 23.05 115.948 -177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -108.46 18.19 21.24 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 120.484 1.493 . . . . 30.92 112.432 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -65.38 -28.96 69.64 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 126.841 2.588 . . . . 19.98 114.075 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' ARG . . . . . 0.436 ' HG3' ' HD2' ' A' ' 127' ' ' LYS . 30.2 ptt180 . . . . . 0 C--O 1.26 1.643 0 CA-C-O 117.821 -1.085 . . . . 24.08 110.731 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' MET . . . . . . . . . . . . . 34.7 mtp . . . . . 0 C--O 1.251 1.184 0 CA-C-O 119.356 -0.354 . . . . 61.45 111.811 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 83.4 mt -87.24 147.86 25.38 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 125.757 1.911 . . . . 53.11 108.879 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' THR . . . . . 0.623 ' OG1' ' HG3' ' D' ' 7' ' ' GLU . 58.7 p -83.62 162.46 20.79 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-N 112.614 -2.084 . . . . 50.79 108.674 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.71 -37.85 52.67 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 125.52 1.762 . . . . 50.39 109.349 179.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.06 -41.46 77.56 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 116.01 1.856 . . . . 63.09 116.01 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' GLU . . . . . 0.623 ' HG3' ' OG1' ' D' ' 4' ' ' THR . 55.2 mt-10 -66.72 -40.71 88.51 Favored 'General case' 0 C--O 1.246 0.872 0 CA-C-N 113.496 -1.684 . . . . 47.82 110.566 177.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' LYS . . . . . . . . . . . . . 7.3 tttt -60.23 -51.16 70.74 Favored 'General case' 0 C--O 1.247 0.945 0 CA-C-O 123.634 1.683 . . . . 59.4 108.124 177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.97 -48.22 82.32 Favored 'General case' 0 C--O 1.25 1.124 0 CA-C-N 114.319 -1.31 . . . . 33.94 109.176 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.97 81.21 Favored 'General case' 0 C--O 1.249 1.034 0 N-CA-C 115.52 1.674 . . . . 25.27 115.52 -179.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.4 -38.79 27.09 Favored 'Isoleucine or valine' 0 C--O 1.246 0.9 0 C-N-CA 124.366 1.066 . . . . 26.72 111.166 -177.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' THR . . . . . . . . . . . . . 24.5 m -64.65 -44.49 90.27 Favored 'General case' 0 C--O 1.249 1.041 0 CA-C-N 114.412 -1.267 . . . . 32.78 111.641 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.67 -39.75 94.22 Favored 'General case' 0 C--O 1.255 1.382 0 CA-C-N 112.606 -2.088 . . . . 29.11 110.437 179.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -72.32 -38.05 68.77 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 125.37 1.669 . . . . 25.64 112.777 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -56.86 -35.06 68.43 Favored 'General case' 0 C--O 1.254 1.332 0 CA-C-N 114.533 -1.212 . . . . 28.98 111.191 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.74 16.66 0.14 Allowed Glycine 0 C--O 1.247 0.936 0 CA-C-O 117.646 -1.641 . . . . 35.04 114.424 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LYS . . . . . . . . . . . . . 7.5 mtpp -126.79 -9.89 6.1 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 122.975 3.387 . . . . 40.23 109.911 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 11.9 t -80.11 133.11 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 O-C-N 127.888 3.242 . . . . 27.87 110.607 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.38 75.64 7.64 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 111.475 -2.602 . . . . 47.6 105.374 176.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -36.06 -48.48 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.69 0 C-N-CA 128.969 2.908 . . . . 36.2 116.1 -178.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.56 -55.13 34.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 122.346 1.07 . . . . 50.26 111.317 -178.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -57.74 -49.42 76.63 Favored 'General case' 0 C--O 1.251 1.169 0 N-CA-C 114.369 1.248 . . . . 56.84 114.369 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' VAL . . . . . . . . . . . . . 4.7 t -64.61 -43.04 96.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 126.708 2.003 . . . . 30.43 110.4 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.71 -49.19 81.21 Favored Glycine 0 C--O 1.249 1.04 0 C-N-CA 126.389 1.947 . . . . 24.07 111.207 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' GLY . . . . . . . . . . . . . . . -66.1 -36.11 91.45 Favored Glycine 0 N--CA 1.47 0.907 0 CA-C-O 123.58 1.656 . . . . 19.24 112.337 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -67.83 -49.57 61.48 Favored 'General case' 0 C--O 1.257 1.489 0 CA-C-N 113.585 -1.307 . . . . 27.12 110.186 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.03 -53.15 60.43 Favored 'General case' 0 C--O 1.257 1.451 0 O-C-N 126.241 2.213 . . . . 17.06 110.497 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' LEU . . . . . . . . . . . . . 30.5 tp -62.26 -38.63 90.02 Favored 'General case' 0 C--O 1.257 1.49 0 C-N-CA 118.29 -1.364 . . . . 17.53 111.571 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.93 -47.06 86.94 Favored Glycine 0 CA--C 1.539 1.557 0 N-CA-C 110.134 -1.187 . . . . 16.9 110.134 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -63.18 -37.54 87.62 Favored 'General case' 0 C--O 1.257 1.487 0 CA-C-O 118.209 -0.901 . . . . 18.47 110.831 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' LEU . . . . . 0.578 HD22 HD23 ' D' ' 106' ' ' LEU . 14.2 tp -57.96 -44.4 87.0 Favored 'General case' 0 C--O 1.267 1.987 0 C-N-CA 125.78 1.632 . . . . 15.73 109.847 177.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' LEU . . . . . . . . . . . . . 72.7 mt -71.94 -26.08 62.14 Favored 'General case' 0 C--O 1.254 1.334 0 CA-C-O 117.954 -1.022 . . . . 18.49 113.153 -179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' VAL . . . . . . . . . . . . . 51.1 t -85.12 -50.16 14.95 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 O-C-N 126.114 2.134 . . . . 15.16 110.797 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 57.1 t -70.19 -38.2 73.96 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 O-C-N 125.531 1.769 . . . . 15.45 113.98 -178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -123.82 76.88 57.29 Favored Pre-proline 0 N--CA 1.479 1.021 0 N-CA-C 106.805 -1.554 . . . . 19.84 106.805 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -55.36 -22.45 33.74 Favored 'Trans proline' 0 C--N 1.313 -1.296 0 O-C-N 126.366 2.772 . . . . 17.49 117.436 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' TRP . . . . . . . . . . . . . 49.4 p90 -68.38 -17.07 64.15 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 120.046 1.294 . . . . 20.28 110.36 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' THR . . . . . . . . . . . . . 67.9 p -68.12 -19.8 64.86 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.004 0.921 . . . . 16.42 109.616 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -61.17 -20.32 62.59 Favored 'General case' 0 C--O 1.245 0.83 0 C-N-CA 124.657 1.183 . . . . 24.85 111.152 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -49.95 -34.8 21.85 Favored 'General case' 0 C--O 1.26 1.617 0 O-C-N 126.023 2.077 . . . . 25.59 112.005 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -88.0 -5.78 58.33 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 122.573 2.442 . . . . 24.29 116.109 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -122.58 39.82 3.83 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.034 1.124 . . . . 30.18 114.034 -174.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.12 -42.35 98.37 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 115.485 -0.779 . . . . 54.61 110.702 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' SER . . . . . . . . . . . . . 78.7 p -64.49 -18.77 65.1 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 127.203 2.201 . . . . 43.27 113.07 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -65.19 -22.2 66.86 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 117.343 -1.313 . . . . 38.47 110.936 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 114.29 -135.12 12.19 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.214 0.946 . . . . 41.72 112.909 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -81.03 124.79 29.46 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.159 1.783 . . . . 50.99 111.799 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.92 11.15 3.36 Favored 'General case' 0 N--CA 1.482 1.167 1 O-C-N 129.237 4.086 . . . . 41.79 109.937 -177.231 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' SER . . . . . . . . . . . . . 66.0 p -56.19 -33.49 65.35 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 116.524 2.046 . . . . 46.22 116.524 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' THR . . . . . . . . . . . . . 28.6 p -129.46 166.26 19.96 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.47 -0.769 . . . . 38.85 112.52 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' D' ' 55' ' ' MET . . . -58.49 -35.06 71.63 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 123.818 1.77 . . . . 32.1 110.642 178.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -73.61 -43.11 60.48 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.055 -1.429 . . . . 44.88 113.646 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.85 -48.69 80.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 125.418 1.699 . . . . 29.05 108.428 179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' VAL . . . . . . . . . . . . . 46.9 t -60.8 -51.66 70.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 122.729 1.252 . . . . 25.33 111.648 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' MET . . . . . 0.576 ' HG2' ' O ' ' D' ' 51' ' ' ALA . 83.3 mmm -63.32 -39.95 95.97 Favored 'General case' 0 C--O 1.257 1.48 0 CA-C-O 118.424 -0.798 . . . . 32.61 112.114 -176.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -87.5 -9.93 53.17 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 116.66 -1.638 . . . . 43.99 113.598 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' ASN . . . . . 0.46 ' O ' ' HG3' ' D' ' 61' ' ' LYS . 22.0 t-20 -56.19 116.57 12.92 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-O 122.863 1.316 . . . . 30.5 111.222 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.31 -23.86 75.51 Favored 'Trans proline' 0 C--O 1.248 1.017 0 C-N-CA 123.395 2.73 . . . . 27.6 114.41 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' LYS . . . . . . . . . . . . . 26.4 mtpt -80.48 -37.22 32.2 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 125.632 1.832 . . . . 43.71 110.482 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' VAL . . . . . . . . . . . . . 39.0 t -60.13 -46.84 93.95 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 CA-C-O 125.154 2.407 . . . . 23.88 108.116 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' LYS . . . . . 0.492 ' HE3' ' O ' ' D' ' 55' ' ' MET . 65.0 mttt -59.64 -47.34 85.99 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 111.44 -2.618 . . . . 51.79 111.806 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.5 -44.22 91.63 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.546 -0.752 . . . . 22.91 110.267 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -66.7 -39.06 87.91 Favored 'General case' 0 C--O 1.258 1.524 0 O-C-N 125.729 1.893 . . . . 24.63 111.534 -179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' GLY . . . . . . . . . . . . . . . -55.35 -44.42 84.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 114.051 -1.432 . . . . 22.78 112.577 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' LYS . . . . . . . . . . . . . 28.1 tttp -64.58 -47.49 78.48 Favored 'General case' 0 C--O 1.245 0.82 0 C-N-CA 126.253 1.821 . . . . 42.37 109.554 -179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -55.33 -50.28 70.03 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 112.698 -2.046 . . . . 39.75 109.388 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' VAL . . . . . 0.418 HG13 ' C3B' ' D' ' 148' ' ' HEM . 69.3 t -61.08 -42.51 93.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 O-C-N 124.94 1.4 . . . . 20.15 111.574 179.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.73 -28.82 66.13 Favored 'General case' 0 C--O 1.258 1.537 0 N-CA-C 115.1 1.519 . . . . 27.06 115.1 -177.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -67.39 -42.73 82.88 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 123.933 1.825 . . . . 41.7 106.747 177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' SER . . . . . . . . . . . . . 26.1 t -62.42 -43.6 98.42 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-N 112.365 -2.198 . . . . 26.43 108.213 -179.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -55.44 -51.62 66.29 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 114.098 -1.41 . . . . 25.57 108.093 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' SER . . . . . 0.443 ' O ' ' HD2' ' D' ' 76' ' ' LYS . 69.2 m -54.26 -38.16 65.49 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 124.965 1.306 . . . . 26.88 111.589 178.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.86 -39.9 90.89 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 125.114 1.509 . . . . 47.94 109.598 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . -62.08 -37.81 95.07 Favored Glycine 0 N--CA 1.468 0.786 0 O-C-N 126.891 2.619 . . . . 31.97 110.204 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' MET . . . . . . . . . . . . . 90.3 mmm -59.87 -24.16 64.02 Favored 'General case' 0 C--O 1.249 1.07 0 C-N-CA 125.462 1.505 . . . . 32.19 112.843 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' LYS . . . . . 0.443 ' HD2' ' O ' ' D' ' 72' ' ' SER . 0.1 OUTLIER -87.82 -12.25 45.52 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 118.195 -0.907 . . . . 44.89 109.354 -179.775 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -126.93 44.99 2.78 Favored 'General case' 0 C--O 1.26 1.622 0 CA-C-O 116.464 -1.731 . . . . 46.14 114.487 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' LEU . . . . . . . . . . . . . 24.5 mt -55.96 -23.35 31.69 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.792 1.308 . . . . 35.92 113.729 -177.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -80.32 -15.71 56.28 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 126.592 1.957 . . . . 56.84 112.807 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.65 71.26 0.98 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.014 -0.674 . . . . 44.71 110.479 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' LEU . . . . . . . . . . . . . 32.4 mt -68.52 -39.01 81.37 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 126.481 2.363 . . . . 32.6 108.171 179.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' LYS . . . . . . . . . . . . . 25.9 mttp -58.62 -45.69 88.67 Favored 'General case' 0 C--O 1.249 1.046 0 O-C-N 125.873 1.983 . . . . 48.54 113.825 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' GLY . . . . . . . . . . . . . . . -69.14 -45.45 61.94 Favored Glycine 0 N--CA 1.47 0.951 0 O-C-N 129.013 3.945 . . . . 30.43 109.227 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' THR . . . . . . . . . . . . . 33.6 m -59.68 -44.99 93.4 Favored 'General case' 0 C--O 1.254 1.29 0 N-CA-C 114.408 1.262 . . . . 28.87 114.408 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -99.0 0.71 44.44 Favored 'General case' 0 C--O 1.254 1.321 0 N-CA-C 116.498 2.036 . . . . 30.29 116.498 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' ALA . . . . . . . . . . . . . . . -48.11 -50.28 29.02 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 120.444 1.475 . . . . 22.87 114.223 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.32 -35.69 81.0 Favored 'General case' 0 C--O 1.25 1.107 0 O-C-N 120.605 -1.309 . . . . 21.1 112.42 -179.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' LEU . . . . . . . . . . . . . 9.4 mt -68.99 -34.17 74.86 Favored 'General case' 0 N--CA 1.484 1.271 0 CA-C-O 117.806 -1.093 . . . . 22.16 111.537 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' SER . . . . . . . . . . . . . 44.2 t -57.06 -55.8 30.02 Favored 'General case' 0 C--N 1.317 -0.825 0 O-C-N 127.485 2.991 . . . . 16.04 107.263 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -55.02 -48.01 73.94 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 126.303 2.252 . . . . 49.65 111.974 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' LEU . . . . . . . . . . . . . 3.6 tp -61.41 -42.6 98.98 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 113.823 -1.535 . . . . 24.19 111.531 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -67.36 -31.3 71.46 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 125.423 1.702 . . . . 16.56 109.818 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' CYS . . . . . . . . . . . . . 40.9 t -78.76 -62.94 1.53 Allowed 'General case' 0 C--O 1.244 0.777 0 O-C-N 124.183 0.927 . . . . 17.35 111.028 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' ASP . . . . . . . . . . . . . 83.6 m-20 -69.23 -43.87 73.18 Favored 'General case' 0 C--O 1.255 1.343 0 N-CA-C 116.907 2.188 . . . . 32.99 116.907 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' D' ' 95' ' ' LYS . 9.1 mptt -98.22 -38.33 9.34 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 117.835 -1.546 . . . . 43.98 113.667 -178.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' LEU . . . . . . . . . . . . . 85.8 mt -88.59 -26.48 21.92 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 114.998 1.481 . . . . 21.73 114.998 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 58.43 43.0 20.32 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 125.055 1.472 . . . . 27.42 110.656 -179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 55.5 t -88.85 117.13 31.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 C-N-CA 124.72 1.208 . . . . 16.28 110.961 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -59.09 122.92 66.73 Favored Pre-proline 0 C--O 1.255 1.378 0 N-CA-C 104.609 -2.367 . . . . 15.77 104.609 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -56.18 -24.77 51.91 Favored 'Trans proline' 0 C--N 1.325 -0.658 0 C-N-CA 123.32 2.68 . . . . 12.26 112.586 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' GLU . . . . . . . . . . . . . 50.3 tp10 -54.12 -32.52 55.32 Favored 'General case' 0 C--O 1.251 1.138 0 O-C-N 121.063 -1.023 . . . . 32.23 110.122 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -58.74 -36.95 75.15 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 120.151 -1.593 . . . . 25.73 112.303 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -61.17 -36.26 79.34 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 106.697 -1.594 . . . . 14.96 106.697 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -70.36 -45.14 66.68 Favored 'General case' 0 C--O 1.248 1.002 0 O-C-N 126.482 2.364 . . . . 37.52 109.133 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' LEU . . . . . . . . . . . . . 23.4 mt -59.49 -41.35 89.61 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 124.222 0.951 . . . . 15.98 111.814 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' LEU . . . . . 0.578 HD23 HD22 ' D' ' 31' ' ' LEU . 3.0 tm? -69.61 -39.42 77.23 Favored 'General case' 0 C--O 1.25 1.091 0 CA-C-N 115.747 -0.661 . . . . 19.02 110.508 -176.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' GLY . . . . . 0.799 ' HA3' HG13 ' D' ' 134' ' ' VAL . . . -59.21 -45.11 95.86 Favored Glycine 0 N--CA 1.48 1.617 0 N-CA-C 108.122 -1.991 . . . . 18.96 108.122 178.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' ASN . . . . . 0.454 ' O ' HG22 ' D' ' 111' ' ' VAL . 77.5 m-20 -65.85 -45.35 82.5 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 120.738 -1.448 . . . . 34.56 112.818 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' VAL . . . . . . . . . . . . . 35.0 t -60.44 -39.69 81.88 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 CA-C-O 123.09 1.424 . . . . 16.34 109.536 176.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' LEU . . . . . . . . . . . . . 22.5 tp -64.54 -41.81 96.12 Favored 'General case' 0 C--O 1.252 1.203 0 O-C-N 119.628 -1.92 . . . . 17.48 108.678 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' VAL . . . . . 0.454 HG22 ' O ' ' D' ' 108' ' ' ASN . 28.2 m -65.97 -34.16 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 107.376 -1.342 . . . . 20.89 107.376 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' VAL . . . . . . . . . . . . . 87.3 t -67.75 -36.37 75.68 Favored 'Isoleucine or valine' 0 C--O 1.254 1.317 0 CA-C-N 119.161 0.891 . . . . 20.29 110.679 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . . 5.1 t -71.07 -40.32 75.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 O-C-N 126.511 2.382 . . . . 18.46 107.626 -179.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' LEU . . . . . . . . . . . . . 30.9 mt -60.08 -43.15 95.69 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 123.477 1.608 . . . . 20.81 108.697 179.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.79 -48.69 80.67 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 122.589 1.185 . . . . 22.73 111.335 179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.4 -27.58 69.4 Favored 'General case' 0 C--O 1.254 1.309 0 CA-C-N 114.505 -1.225 . . . . 38.48 113.248 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -90.44 -28.74 18.41 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 114.662 -2.59 . . . . 29.58 113.089 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -108.95 -2.02 18.6 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 115.072 1.508 . . . . 29.56 115.072 -176.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.72 -130.71 5.14 Favored Glycine 0 CA--C 1.535 1.306 0 N-CA-C 110.446 -1.062 . . . . 28.85 110.446 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.01 -19.0 27.73 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 116.274 -1.822 . . . . 49.27 114.618 -176.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -70.86 -25.03 62.63 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 125.96 2.037 . . . . 46.58 112.16 178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -87.83 75.26 8.91 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 127.078 2.736 . . . . 31.29 107.331 179.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' THR . . . . . . . . . . . . . 29.9 p -69.49 159.85 81.83 Favored Pre-proline 0 C--N 1.314 -0.959 0 N-CA-C 117.552 2.427 . . . . 26.17 117.552 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.55 -40.89 45.68 Favored 'Trans proline' 0 C--O 1.259 1.565 0 O-C-N 123.423 1.223 . . . . 25.83 111.684 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 91.0 t -70.26 -39.0 76.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 120.853 -1.155 . . . . 25.55 111.987 -179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' LEU . . . . . 0.409 HD12 ' HA ' ' D' ' 126' ' ' LEU . 1.9 tp -62.91 -53.42 54.4 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.042 -1.435 . . . . 30.86 107.666 -179.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -52.48 -43.0 64.74 Favored 'General case' 0 C--N 1.309 -1.175 0 O-C-N 125.718 1.886 . . . . 27.81 111.288 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' ALA . . . . . . . . . . . . . . . -60.08 -42.8 95.39 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 124.74 1.275 . . . . 22.17 109.509 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.22 -45.33 93.83 Favored 'General case' 0 C--N 1.314 -0.957 0 O-C-N 126.435 2.335 . . . . 32.61 110.503 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -67.03 -34.71 78.31 Favored 'General case' 0 C--O 1.248 1.015 0 O-C-N 125.013 1.445 . . . . 37.75 111.127 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -59.7 -37.91 80.12 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 126.874 2.609 . . . . 26.28 107.39 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 66.3 mttt -69.65 -39.41 77.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.988 -1.006 . . . . 30.53 111.407 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' VAL . . . . . . . . . . . . . 37.4 t -63.54 -55.58 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-O 122.787 1.28 . . . . 18.19 110.852 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' VAL . . . . . 0.799 HG13 ' HA3' ' D' ' 107' ' ' GLY 0.306 2.3 t -51.34 -40.42 23.51 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 CA-C-N 112.099 -2.319 . . . . 17.69 111.932 179.058 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.35 -50.16 48.89 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.676 1.59 . . . . 15.92 108.72 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' GLY . . . . . . . . . . . . . . . -61.24 -36.51 92.54 Favored Glycine 0 N--CA 1.478 1.436 0 CA-C-O 118.05 -1.417 . . . . 18.56 110.328 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.28 -49.27 62.5 Favored 'Isoleucine or valine' 0 C--O 1.25 1.091 0 CA-C-N 119.75 1.775 . . . . 16.67 110.564 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' ALA . . . . . . . . . . . . . . . -55.2 -39.63 69.85 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.259 1.028 . . . . 17.95 109.315 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -69.9 -42.43 73.39 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 114.874 -2.489 . . . . 49.61 111.362 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' ALA . . . . . . . . . . . . . . . -65.37 -38.47 90.14 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 127.647 3.092 . . . . 21.29 108.974 179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' LEU . . . . . . . . . . . . . 13.1 mt -69.88 -24.46 63.42 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.84 1.422 . . . . 20.27 114.84 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' ALA . . . . . . . . . . . . . . . -96.02 -8.44 33.61 Favored 'General case' 0 C--N 1.301 -1.515 0 CA-C-O 125.785 2.707 . . . . 25.77 116.58 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' HIS . . . . . . . . . . . . 0.317 1.6 t-80 -63.74 -24.36 67.74 Favored 'General case' 0 C--O 1.261 1.673 0 CA-C-N 112.149 -2.296 . . . . 50.94 116.342 -174.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' ARG . . . . . . . . . . . . . 12.0 mmt180 -104.33 12.57 33.39 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-N 121.386 1.903 . . . . 56.23 111.695 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -68.44 144.91 54.52 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 105.715 -1.957 . . . . 24.06 105.715 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' HIS . . . . . . . . . . . . . 34.5 p80 . . . . . 0 C--O 1.262 1.732 0 CA-C-O 114.002 -2.904 . . . . 36.49 108.305 -178.646 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' HEM . . . . . 0.593 ' HHC' HBB2 ' B' ' 148' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 143' ' ' HEM . . . . . 0.465 HBB2 ' CMB' ' C' ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 148' ' ' HEM . . . . . 0.418 ' C3B' HG13 ' D' ' 67' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 752' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 758' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 759' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 762' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 764' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 765' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 769' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 770' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 771' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 772' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 773' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 776' ' ' HOH . . . . . 0.695 ' O ' ' OD1' ' A' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 781' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 782' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 785' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 786' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 788' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 789' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 790' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 751' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 753' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 754' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 763' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 766' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 775' ' ' HOH . . . . . 0.412 ' O ' ' HB3' ' B' ' 143' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 777' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 783' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 756' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 761' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 774' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 778' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 779' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 780' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 784' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 787' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 791' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 792' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 760' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 767' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 768' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 793' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 794' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_