data_3oao_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 3oao _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 ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.591 0 N-CA-C 112.433 -0.267 . . . . 124.19 112.433 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.05 17.05 2.08 Favored 'General case' 0 CA--C 1.579 2.07 0 N-CA-C 113.269 0.84 . . . . 144.22999999999999 113.269 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.3 m -65.32 -47.24 77.22 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.57 1.948 . . . . 120.54000000000001 112.939 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -37.92 75.96 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.499 0.72 . . . . 105.89 112.741 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.4 t -66.02 -44.15 85.55 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.4 1.08 . . . . 127.77 109.574 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -66.61 -39.4 88.34 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 122.799 0.44 . . . . 111.98 111.59 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.5 98.61 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 123.924 0.89 . . . . 100.61 110.138 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.78 -44.29 93.85 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.996 0.918 . . . . 140.72999999999999 110.175 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -62.49 -38.99 92.01 Favored 'General case' 0 C--N 1.347 0.471 0 C-N-CA 122.608 0.363 . . . . 147.78 110.424 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.5 -49.38 76.96 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.816 0.446 . . . . 94.069999999999993 111.543 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.8 mt -61.42 -30.8 70.79 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 123.506 0.722 . . . . 97.510000000000005 112.174 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.8 -56.2 7.78 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 108.907 -0.775 . . . . 142.15000000000001 108.907 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.4 mt -53.56 -38.82 64.25 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 125.008 1.323 . . . . 105.88 112.434 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -7.33 10.89 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 124.13 0.972 . . . . 99.530000000000001 113.237 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 59.5 44.35 14.95 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 125.046 1.338 . . . . 109.06 111.815 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.55 -18.4 65.34 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.451 1.1 . . . . 105.04000000000001 111.253 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -69.49 -26.5 64.58 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.594 0.758 . . . . 126.95999999999999 111.787 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.2 -0.64 57.33 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.024 0.93 . . . . 129.47 112.909 -178.105 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.5 mp -60.44 -27.07 67.21 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.812 0.671 . . . . 111.45999999999999 112.812 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.0 p -84.02 -19.27 34.75 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 114.992 1.478 . . . . 117.75 114.992 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 45.8 t -41.3 -45.38 7.01 Favored Pre-proline 0 CA--C 1.568 1.638 0 N-CA-C 114.308 1.225 . . . . 115.27 114.308 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -57.23 -36.23 99.01 Favored 'Trans proline' 0 C--N 1.367 1.521 0 CA-C-N 121.041 1.407 . . . . 116.7 114.498 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.58 -42.87 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.295 0.638 . . . . 118.33 110.719 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.73 -36.92 84.97 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.75 0.82 . . . . 124.16 111.221 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.45 68.38 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.767 0.827 . . . . 126.81 110.873 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -58.88 -43.32 90.92 Favored 'General case' 0 C--N 1.358 0.939 0 C-N-CA 123.906 0.882 . . . . 170.34 111.938 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.73 -33.85 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 122.67 0.388 . . . . 132.66 111.259 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -69.32 -42.4 75.43 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.669 0.788 . . . . 159.25999999999999 110.562 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . . . -71.25 -29.81 65.55 Favored 'General case' 0 C--N 1.36 1.063 0 C-N-CA 123.712 0.805 . . . . 150.03999999999999 111.36 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' MSE . . . . . . . . . . . . . 24.8 ttm -66.78 -38.91 87.47 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 125.084 1.354 . . . . 166.72999999999999 110.948 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.9 mt -71.92 -43.46 65.26 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 123.447 0.699 . . . . 154.06999999999999 111.485 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.85 76.95 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.044 0.538 . . . . 157.44 110.274 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.66 -36.9 73.6 Favored 'General case' 0 C--N 1.363 1.187 0 C-N-CA 124.72 1.208 . . . . 198.65000000000001 110.18 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -72.88 -33.53 66.11 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.039 0.936 . . . . 191.94999999999999 109.354 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -66.48 -45.59 79.18 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 125.04 1.336 . . . . 171.87 109.759 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.02 -53.03 35.19 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.272 0.629 . . . . 176.44999999999999 109.737 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . . . -32.58 -40.3 0.05 OUTLIER 'General case' 0 C--N 1.37 1.497 0 C-N-CA 127.249 2.22 . . . . 182.03999999999999 115.637 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -134.92 129.18 33.9 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.402 0.281 . . . . 187.66 110.785 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . 61.35 -89.07 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.976 1.71 . . . . 192.33000000000001 113.406 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 75.25 62.17 0.26 Allowed Pre-proline 0 CA--C 1.568 1.666 0 C-N-CA 127.411 2.284 . . . . 189.47 116.186 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -84.18 108.09 1.31 Allowed 'Trans proline' 0 C--N 1.366 1.454 0 CA-C-N 120.038 1.049 . . . . 191.19 110.726 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . . . -52.64 -10.69 0.16 Allowed 'General case' 0 C--N 1.362 1.136 0 N-CA-C 114.409 1.263 . . . . 181.50999999999999 114.409 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 79.0 p -77.44 -19.57 55.85 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 124.065 0.946 . . . . 188.78999999999999 109.862 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -114.99 37.22 3.55 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 123.81 0.844 . . . . 205.25999999999999 112.863 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -76.39 -18.58 58.79 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 122.811 0.444 . . . . 168.93000000000001 111.134 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.33 -16.51 63.0 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 123.687 0.795 . . . . 162.61000000000001 111.139 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.1 t -76.62 -41.26 34.04 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 N-CA-C 107.736 -1.209 . . . . 164.90000000000001 107.736 174.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 tp -65.47 -36.43 83.85 Favored 'General case' 0 C--N 1.362 1.133 0 C-N-CA 123.406 0.682 . . . . 157.30000000000001 109.672 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -54.37 -46.18 72.98 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 124.735 1.214 . . . . 195.93000000000001 111.953 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 11.3 ptt-85 -75.25 -36.72 61.23 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 112.717 0.636 . . . . 186.78 112.717 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -67.94 -29.93 69.11 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 117.868 0.304 . . . . 146.97999999999999 111.608 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -76.15 -28.15 57.26 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 122.678 0.391 . . . . 151.99000000000001 110.08 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.86 -39.5 61.51 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.117 -0.697 . . . . 119.88 109.117 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -61.4 -48.7 80.02 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.888 1.275 . . . . 145.38999999999999 109.746 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.56 -38.43 84.53 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.29 1.036 . . . . 116.45999999999999 110.631 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -65.34 -41.43 93.92 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.509 0.723 . . . . 143.47999999999999 109.888 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 -35.26 76.81 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.536 0.734 . . . . 109.73999999999999 111.657 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -73.34 -32.72 64.71 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 123.465 0.706 . . . . 128.46000000000001 112.099 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 59.8 mt -73.34 -39.48 65.18 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 107.712 -1.218 . . . . 109.81 107.712 175.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -59.0 -30.8 68.25 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 122.923 0.489 . . . . 124.45999999999999 111.324 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -68.67 -43.54 75.93 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 123.306 0.642 . . . . 106.56999999999999 110.486 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.34 -57.85 2.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.598 0.592 . . . . 100.5 112.598 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 3.7 pt -117.38 26.46 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 116.194 1.924 . . . . 104.33 116.194 -172.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.67 152.59 51.59 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.34 -1.104 . . . . 98.670000000000002 110.34 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -52.43 -35.76 52.89 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.523 0.935 . . . . 97.810000000000002 113.523 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.96 -22.11 66.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.382 1.073 . . . . 119.66 112.253 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -91.38 -37.57 13.14 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.078 0.551 . . . . 105.61 110.436 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 31.6 mm -75.73 -51.49 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.873 1.269 . . . . 103.55 111.637 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -42.15 -49.3 11.61 Favored Pre-proline 0 CA--C 1.554 1.107 0 N-CA-C 115.896 1.813 . . . . 135.81999999999999 115.896 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -62.57 -37.31 59.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 CA-C-N 120.508 1.217 . . . . 102.48999999999999 114.07 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.79 -23.54 42.07 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 113.537 0.94 . . . . 157.83000000000001 113.537 -177.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 37.1 mt -77.61 -31.81 53.12 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-O 119.668 -0.206 . . . . 97.150000000000006 110.553 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.55 -45.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 N-CA-C 108.279 -1.008 . . . . 97.900000000000006 108.279 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -57.07 -41.43 78.78 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 109.642 -0.503 . . . . 142.06 109.642 176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.13 -44.02 92.01 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.682 1.193 . . . . 100.61 112.582 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -81.38 -39.11 25.5 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.755 1.391 . . . . 102.36 114.755 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 77.2 p -68.17 -28.66 67.48 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-O 119.306 -0.378 . . . . 100.34 111.407 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 43.1 p -83.41 -23.89 32.16 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 119.312 -0.375 . . . . 113.28 111.888 179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -99.09 -15.3 19.05 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.869 1.063 . . . . 106.20999999999999 113.869 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -136.05 152.3 50.75 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 122.726 0.41 . . . . 97.519999999999996 111.52 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.4 p -82.83 163.37 21.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 107.429 -1.323 . . . . 98.560000000000002 107.429 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -58.08 -39.59 78.94 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.109 0.564 . . . . 125.13 109.689 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.6 p -67.98 -36.53 80.18 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 122.913 0.485 . . . . 105.95999999999999 111.757 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -67.75 -43.99 78.58 Favored 'General case' 0 C--N 1.365 1.243 0 CA-C-O 119.012 -0.518 . . . . 102.73 109.755 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.27 -40.06 96.33 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 123.783 0.833 . . . . 95.950000000000003 111.052 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -60.25 -44.73 95.02 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.336 1.054 . . . . 162.94999999999999 109.622 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -68.39 -34.49 76.13 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.853 1.261 . . . . 106.06 113.038 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.85 -39.09 90.45 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 108.837 -0.801 . . . . 93.609999999999999 108.837 174.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.73 -41.81 95.69 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.233 0.613 . . . . 100.06 111.391 176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.77 98.37 Favored 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.622 0.769 . . . . 95.909999999999997 109.858 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -64.3 -51.19 64.72 Favored 'General case' 0 C--N 1.364 1.209 0 CA-C-O 118.778 -0.629 . . . . 98.349999999999994 112.078 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -74.09 -12.51 60.63 Favored 'General case' 0 C--N 1.348 0.501 0 N-CA-C 115.546 1.684 . . . . 117.29000000000001 115.546 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -82.87 -29.58 29.24 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 108.522 -0.918 . . . . 145.88 108.522 174.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 13.4 p -64.46 153.45 86.66 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.802 1.241 . . . . 98.400000000000006 112.376 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.86 -36.7 92.14 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 113.886 0.687 . . . . 100.66 113.886 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.2 tp -70.05 -39.57 75.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 119.434 -0.317 . . . . 96.420000000000002 111.096 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -58.51 -47.57 89.18 Favored Glycine 0 C--O 1.237 0.298 0 N-CA-C 111.124 -0.79 . . . . 93.109999999999999 111.124 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -62.61 -36.62 83.35 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.778 0.831 . . . . 145.56999999999999 111.175 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -65.83 -44.78 84.54 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 109.709 -0.478 . . . . 97.549999999999997 109.709 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 72.3 t -56.79 -51.29 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.13 0.572 . . . . 92.620000000000005 110.339 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -54.41 -42.94 71.06 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 113.735 1.013 . . . . 94.510000000000005 113.735 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -72.53 -42.95 64.17 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 118.26 0.482 . . . . 160.25 111.611 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -71.26 -40.99 70.65 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 113.831 1.049 . . . . 107.22 113.831 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' MSE . . . . . . . . . . . . 0.377 15.0 mmt -46.91 -50.66 43.77 Favored Pre-proline 0 C--N 1.355 0.818 0 N-CA-C 118.385 2.735 . . . . 131.33000000000001 118.385 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -54.77 -46.35 33.99 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 CA-C-N 121.258 1.485 . . . . 113.40000000000001 113.685 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 29.0 ttp85 -70.12 -40.92 74.59 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.856 0.687 . . . . 138.84999999999999 112.856 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.61 -39.04 93.36 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 119.371 -0.347 . . . . 100.66 111.044 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.1 m -64.93 -46.5 81.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.621 0.768 . . . . 111.95 110.588 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.81 -46.37 88.25 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 124.229 1.012 . . . . 109.05 111.783 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -65.44 -38.39 89.73 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.428 0.691 . . . . 145.90000000000001 111.029 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 25.7 t -64.61 -40.99 96.47 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.254 1.422 . . . . 116.13 110.342 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.71 -32.12 62.05 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.708 0.803 . . . . 107.44 112.38 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -68.54 -40.7 80.61 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.893 -0.78 . . . . 160.02000000000001 108.893 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.8 tp -57.13 -54.06 51.04 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.023 1.729 . . . . 113.73999999999999 110.196 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 39.7 m -62.2 -46.96 86.58 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 124.072 0.949 . . . . 111.06999999999999 112.44 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -61.39 -37.68 84.32 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 122.737 0.415 . . . . 167.49000000000001 111.12 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.27 -47.07 80.98 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 122.609 0.364 . . . . 115.97 110.476 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -64.49 -41.48 96.44 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 125.01 1.324 . . . . 120.43000000000001 111.002 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.9 -29.22 68.21 Favored 'General case' 0 C--N 1.36 1.028 0 C-N-CA 125.511 1.524 . . . . 112.20999999999999 112.967 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -64.07 -22.4 66.92 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.016 0.376 . . . . 165.34 112.016 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -69.47 -24.29 76.19 Favored Glycine 0 C--N 1.34 0.78 0 O-C-N 123.72 0.637 . . . . 111.3 113.285 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -93.77 -1.07 55.52 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.624 0.769 . . . . 114.45 112.201 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.88 -56.27 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.101 0.56 . . . . 121.68000000000001 112.469 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -59.68 -48.61 94.92 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-O 117.819 -1.086 . . . . 170.83000000000001 111.988 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -63.03 -37.83 50.34 Favored 'Trans proline' 0 C--N 1.374 1.902 0 CA-C-N 120.824 1.33 . . . . 119.20999999999999 114.453 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.0 t -70.49 -33.49 53.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 118.343 0.519 . . . . 124.09 110.377 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -66.21 -45.81 79.43 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 123.067 0.547 . . . . 147.5 109.619 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -62.51 -40.91 98.27 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 125.646 1.579 . . . . 133.96000000000001 109.305 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.71 -51.79 68.46 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.447 1.899 . . . . 137.34 112.3 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' MSE . . . . . . . . . . . . . 83.8 mtp -65.86 -39.58 90.86 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.223 0.609 . . . . 153.36000000000001 110.955 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.39 -37.86 84.96 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 124.789 1.236 . . . . 148.08000000000001 110.648 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -70.01 -37.68 75.73 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.956 0.902 . . . . 149.86000000000001 110.926 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -68.11 -41.6 81.5 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 118.255 0.48 . . . . 150.16 110.046 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . . . -63.62 -36.08 82.63 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 123.539 0.735 . . . . 159.25 109.527 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -66.1 -47.86 72.82 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 123.552 0.741 . . . . 194.28999999999999 109.936 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.16 -38.89 92.68 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 125.267 1.427 . . . . 177.68000000000001 113.274 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 24.7 mt -83.62 -3.85 58.08 Favored 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 112.34 0.496 . . . . 173.87 112.34 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 76.37 65.91 1.93 Allowed Glycine 0 C--N 1.339 0.723 0 C-N-CA 123.865 0.745 . . . . 182.25 113.656 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 15.0 t -126.83 127.6 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.186 0.995 . . . . 181.31 110.005 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.386 0 C-N-CA 126.255 1.822 . . . . 224.75999999999999 113.376 -179.627 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.591 0 N-CA-C 112.433 -0.267 . . . . 124.19 112.433 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.05 17.05 2.08 Favored 'General case' 0 CA--C 1.579 2.07 0 N-CA-C 113.269 0.84 . . . . 144.23 113.269 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.3 m -65.32 -47.24 77.22 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.57 1.948 . . . . 120.54 112.939 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -37.92 75.96 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.499 0.72 . . . . 105.89 112.741 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.4 t -66.02 -44.15 85.55 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.4 1.08 . . . . 127.77 109.574 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -66.61 -39.4 88.34 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 122.799 0.44 . . . . 111.98 111.59 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.5 98.61 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 123.924 0.89 . . . . 100.61 110.138 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.78 -44.29 93.85 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.996 0.918 . . . . 140.73 110.175 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -62.49 -38.99 92.01 Favored 'General case' 0 C--N 1.347 0.471 0 C-N-CA 122.608 0.363 . . . . 147.78 110.424 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.5 -49.38 76.96 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.816 0.446 . . . . 94.07 111.543 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.8 mt -61.42 -30.8 70.79 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 123.506 0.722 . . . . 97.51 112.174 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.8 -56.2 7.78 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 108.907 -0.775 . . . . 142.15 108.907 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.4 mt -53.56 -38.82 64.25 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 125.008 1.323 . . . . 105.88 112.434 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -7.33 10.89 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 124.13 0.972 . . . . 99.53 113.237 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 59.5 44.35 14.95 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 125.046 1.338 . . . . 109.06 111.815 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' ' 54' ' ' LEU . . . -66.55 -18.4 65.34 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.451 1.1 . . . . 105.04 111.253 179.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -69.49 -26.5 64.58 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.594 0.758 . . . . 126.96 111.787 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.2 -0.64 57.33 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.024 0.93 . . . . 129.47 112.909 -178.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 51' ' ' ALA . 3.5 mp -60.44 -27.07 67.21 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.812 0.671 . . . . 111.46 112.812 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.0 p -84.02 -19.27 34.75 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 114.992 1.478 . . . . 117.75 114.992 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 45.8 t -41.3 -45.38 7.01 Favored Pre-proline 0 CA--C 1.568 1.638 0 N-CA-C 114.308 1.225 . . . . 115.27 114.308 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -57.23 -36.23 99.01 Favored 'Trans proline' 0 C--N 1.367 1.521 0 CA-C-N 121.041 1.407 . . . . 116.7 114.498 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.58 -42.87 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.295 0.638 . . . . 118.33 110.719 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.73 -36.92 84.97 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.75 0.82 . . . . 124.16 111.221 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.45 68.38 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.767 0.827 . . . . 126.81 110.873 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -58.88 -43.32 90.92 Favored 'General case' 0 C--N 1.358 0.939 0 C-N-CA 123.906 0.882 . . . . 170.34 111.938 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.73 -33.85 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 122.67 0.388 . . . . 132.66 111.259 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -69.32 -42.4 75.43 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.669 0.788 . . . . 159.26 110.562 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . . . -71.25 -29.81 65.55 Favored 'General case' 0 C--N 1.36 1.063 0 C-N-CA 123.712 0.805 . . . . 150.04 111.36 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' MSE . . . . . . . . . . . . . 24.8 ttm -66.78 -38.91 87.47 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 125.084 1.354 . . . . 166.73 110.948 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.9 mt -71.92 -43.46 65.26 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 123.447 0.699 . . . . 154.07 111.485 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.85 76.95 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.044 0.538 . . . . 157.44 110.274 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.66 -36.9 73.6 Favored 'General case' 0 C--N 1.363 1.187 0 C-N-CA 124.72 1.208 . . . . 198.65 110.18 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -72.88 -33.53 66.11 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.039 0.936 . . . . 191.95 109.354 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . 0.413 ' HB2' HD13 ' A' ' 83' ' ' LEU . 53.8 t80 -66.48 -45.59 79.18 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 125.04 1.336 . . . . 171.87 109.759 178.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.02 -53.03 35.19 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.272 0.629 . . . . 176.45 109.737 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . . . -32.58 -40.3 0.05 OUTLIER 'General case' 0 C--N 1.37 1.497 0 C-N-CA 127.249 2.22 . . . . 182.04 115.637 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -134.92 129.18 33.9 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.402 0.281 . . . . 187.66 110.785 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . 61.35 -89.07 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.976 1.71 . . . . 192.33 113.406 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 75.25 62.17 0.26 Allowed Pre-proline 0 CA--C 1.568 1.666 0 C-N-CA 127.411 2.284 . . . . 189.47 116.186 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -84.18 108.09 1.31 Allowed 'Trans proline' 0 C--N 1.366 1.454 0 CA-C-N 120.038 1.049 . . . . 191.19 110.726 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . . . -52.64 -10.69 0.16 Allowed 'General case' 0 C--N 1.362 1.136 0 N-CA-C 114.409 1.263 . . . . 181.51 114.409 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 79.0 p -77.44 -19.57 55.85 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 124.065 0.946 . . . . 188.79 109.862 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -114.99 37.22 3.55 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 123.81 0.844 . . . . 205.26 112.863 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -76.39 -18.58 58.79 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 122.811 0.444 . . . . 168.93 111.134 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.33 -16.51 63.0 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 123.687 0.795 . . . . 162.61 111.139 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.1 t -76.62 -41.26 34.04 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 N-CA-C 107.736 -1.209 . . . . 164.9 107.736 174.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 70' ' ' PHE . 16.4 tp -65.47 -36.43 83.85 Favored 'General case' 0 C--N 1.362 1.133 0 C-N-CA 123.406 0.682 . . . . 157.3 109.672 175.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -54.37 -46.18 72.98 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 124.735 1.214 . . . . 195.93 111.953 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 11.3 ptt-85 -75.25 -36.72 61.23 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 112.717 0.636 . . . . 186.78 112.717 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -67.94 -29.93 69.11 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 117.868 0.304 . . . . 146.98 111.608 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -76.15 -28.15 57.26 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 122.678 0.391 . . . . 151.99 110.08 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.86 -39.5 61.51 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.117 -0.697 . . . . 119.88 109.117 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -61.4 -48.7 80.02 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.888 1.275 . . . . 145.39 109.746 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.56 -38.43 84.53 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.29 1.036 . . . . 116.46 110.631 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -65.34 -41.43 93.92 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.509 0.723 . . . . 143.48 109.888 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 -35.26 76.81 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.536 0.734 . . . . 109.74 111.657 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -73.34 -32.72 64.71 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 123.465 0.706 . . . . 128.46 112.099 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 59.8 mt -73.34 -39.48 65.18 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 107.712 -1.218 . . . . 109.81 107.712 175.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -59.0 -30.8 68.25 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 122.923 0.489 . . . . 124.46 111.324 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -68.67 -43.54 75.93 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 123.306 0.642 . . . . 106.57 110.486 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.34 -57.85 2.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.598 0.592 . . . . 100.5 112.598 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 3.7 pt -117.38 26.46 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 116.194 1.924 . . . . 104.33 116.194 -172.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.67 152.59 51.59 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.34 -1.104 . . . . 98.67 110.34 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -52.43 -35.76 52.89 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.523 0.935 . . . . 97.81 113.523 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.96 -22.11 66.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.382 1.073 . . . . 119.66 112.253 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -91.38 -37.57 13.14 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.078 0.551 . . . . 105.61 110.436 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 31.6 mm -75.73 -51.49 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.873 1.269 . . . . 103.55 111.637 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -42.15 -49.3 11.61 Favored Pre-proline 0 CA--C 1.554 1.107 0 N-CA-C 115.896 1.813 . . . . 135.82 115.896 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -62.57 -37.31 59.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 CA-C-N 120.508 1.217 . . . . 102.49 114.07 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.79 -23.54 42.07 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 113.537 0.94 . . . . 157.83 113.537 -177.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 37.1 mt -77.61 -31.81 53.12 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-O 119.668 -0.206 . . . . 97.15 110.553 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.55 -45.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 N-CA-C 108.279 -1.008 . . . . 97.9 108.279 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 113' ' ' THR . 63.8 mttt -57.07 -41.43 78.78 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 109.642 -0.503 . . . . 142.06 109.642 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.13 -44.02 92.01 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.682 1.193 . . . . 100.61 112.582 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -81.38 -39.11 25.5 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.755 1.391 . . . . 102.36 114.755 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 77.2 p -68.17 -28.66 67.48 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-O 119.306 -0.378 . . . . 100.34 111.407 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 109' ' ' LYS . 43.1 p -83.41 -23.89 32.16 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 119.312 -0.375 . . . . 113.28 111.888 179.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -99.09 -15.3 19.05 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.869 1.063 . . . . 106.21 113.869 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -136.05 152.3 50.75 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 122.726 0.41 . . . . 97.52 111.52 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.4 p -82.83 163.37 21.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 107.429 -1.323 . . . . 98.56 107.429 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -58.08 -39.59 78.94 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.109 0.564 . . . . 125.13 109.689 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.6 p -67.98 -36.53 80.18 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 122.913 0.485 . . . . 105.96 111.757 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -67.75 -43.99 78.58 Favored 'General case' 0 C--N 1.365 1.243 0 CA-C-O 119.012 -0.518 . . . . 102.73 109.755 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.27 -40.06 96.33 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 123.783 0.833 . . . . 95.95 111.052 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -60.25 -44.73 95.02 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.336 1.054 . . . . 162.95 109.622 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -68.39 -34.49 76.13 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.853 1.261 . . . . 106.06 113.038 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.85 -39.09 90.45 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 108.837 -0.801 . . . . 93.61 108.837 174.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.73 -41.81 95.69 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.233 0.613 . . . . 100.06 111.391 176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.77 98.37 Favored 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.622 0.769 . . . . 95.91 109.858 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -64.3 -51.19 64.72 Favored 'General case' 0 C--N 1.364 1.209 0 CA-C-O 118.778 -0.629 . . . . 98.35 112.078 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -74.09 -12.51 60.63 Favored 'General case' 0 C--N 1.348 0.501 0 N-CA-C 115.546 1.684 . . . . 117.29 115.546 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -82.87 -29.58 29.24 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 108.522 -0.918 . . . . 145.88 108.522 174.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 13.4 p -64.46 153.45 86.66 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.802 1.241 . . . . 98.4 112.376 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PRO . . . . . 0.401 ' HD2' 'CL ' ' A' ' 4' ' ' ' CL' . 51.5 Cg_exo -54.86 -36.7 92.14 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 113.886 0.687 . . . . 100.66 113.886 179.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.2 tp -70.05 -39.57 75.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 119.434 -0.317 . . . . 96.42 111.096 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -58.51 -47.57 89.18 Favored Glycine 0 C--O 1.237 0.298 0 N-CA-C 111.124 -0.79 . . . . 93.11 111.124 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -62.61 -36.62 83.35 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.778 0.831 . . . . 145.57 111.175 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -65.83 -44.78 84.54 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 109.709 -0.478 . . . . 97.55 109.709 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 72.3 t -56.79 -51.29 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.13 0.572 . . . . 92.62 110.339 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -54.41 -42.94 71.06 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 113.735 1.013 . . . . 94.51 113.735 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -72.53 -42.95 64.17 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 118.26 0.482 . . . . 160.25 111.611 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -71.26 -40.99 70.65 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 113.831 1.049 . . . . 107.22 113.831 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' MSE . . . . . . . . . . . . 0.377 15.0 mmt -46.91 -50.66 43.77 Favored Pre-proline 0 C--N 1.355 0.818 0 N-CA-C 118.385 2.735 . . . . 131.33 118.385 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -54.77 -46.35 33.99 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 CA-C-N 121.258 1.485 . . . . 113.4 113.685 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 29.0 ttp85 -70.12 -40.92 74.59 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.856 0.687 . . . . 138.85 112.856 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.61 -39.04 93.36 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 119.371 -0.347 . . . . 100.66 111.044 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.1 m -64.93 -46.5 81.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.621 0.768 . . . . 111.95 110.588 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.81 -46.37 88.25 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 124.229 1.012 . . . . 109.05 111.783 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -65.44 -38.39 89.73 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.428 0.691 . . . . 145.9 111.029 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 25.7 t -64.61 -40.99 96.47 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.254 1.422 . . . . 116.13 110.342 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.71 -32.12 62.05 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.708 0.803 . . . . 107.44 112.38 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -68.54 -40.7 80.61 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.893 -0.78 . . . . 160.02 108.893 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.8 tp -57.13 -54.06 51.04 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.023 1.729 . . . . 113.74 110.196 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 39.7 m -62.2 -46.96 86.58 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 124.072 0.949 . . . . 111.07 112.44 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -61.39 -37.68 84.32 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 122.737 0.415 . . . . 167.49 111.12 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.27 -47.07 80.98 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 122.609 0.364 . . . . 115.97 110.476 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -64.49 -41.48 96.44 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 125.01 1.324 . . . . 120.43 111.002 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.9 -29.22 68.21 Favored 'General case' 0 C--N 1.36 1.028 0 C-N-CA 125.511 1.524 . . . . 112.21 112.967 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -64.07 -22.4 66.92 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.016 0.376 . . . . 165.34 112.016 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -69.47 -24.29 76.19 Favored Glycine 0 C--N 1.34 0.78 0 O-C-N 123.72 0.637 . . . . 111.3 113.285 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -93.77 -1.07 55.52 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.624 0.769 . . . . 114.45 112.201 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.88 -56.27 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.101 0.56 . . . . 121.68 112.469 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -59.68 -48.61 94.92 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-O 117.819 -1.086 . . . . 170.83 111.988 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -63.03 -37.83 50.34 Favored 'Trans proline' 0 C--N 1.374 1.902 0 CA-C-N 120.824 1.33 . . . . 119.21 114.453 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.0 t -70.49 -33.49 53.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 118.343 0.519 . . . . 124.09 110.377 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -66.21 -45.81 79.43 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 123.067 0.547 . . . . 147.5 109.619 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -62.51 -40.91 98.27 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 125.646 1.579 . . . . 133.96 109.305 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.71 -51.79 68.46 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.447 1.899 . . . . 137.34 112.3 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' MSE . . . . . . . . . . . . . 83.8 mtp -65.86 -39.58 90.86 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.223 0.609 . . . . 153.36 110.955 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.39 -37.86 84.96 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 124.789 1.236 . . . . 148.08 110.648 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -70.01 -37.68 75.73 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.956 0.902 . . . . 149.86 110.926 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -68.11 -41.6 81.5 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 118.255 0.48 . . . . 150.16 110.046 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . . . -63.62 -36.08 82.63 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 123.539 0.735 . . . . 159.25 109.527 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -66.1 -47.86 72.82 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 123.552 0.741 . . . . 194.29 109.936 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.16 -38.89 92.68 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 125.267 1.427 . . . . 177.68 113.274 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 24.7 mt -83.62 -3.85 58.08 Favored 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 112.34 0.496 . . . . 173.87 112.34 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 76.37 65.91 1.93 Allowed Glycine 0 C--N 1.339 0.723 0 C-N-CA 123.865 0.745 . . . . 182.25 113.656 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 15.0 t -126.83 127.6 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.186 0.995 . . . . 181.31 110.005 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.386 0 C-N-CA 126.255 1.822 . . . . 224.76 113.376 -179.627 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' CL' . . . . . 0.401 'CL ' ' HD2' ' A' ' 130' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.591 0 N-CA-C 112.433 -0.267 . . . . 124.19 112.433 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.05 17.05 2.08 Favored 'General case' 0 CA--C 1.579 2.07 0 N-CA-C 113.269 0.84 . . . . 144.22999999999999 113.269 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 69.3 m -65.32 -47.24 77.22 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.57 1.948 . . . . 120.54000000000001 112.939 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.28 -37.92 75.96 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.499 0.72 . . . . 105.89 112.741 -177.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.4 t -66.02 -44.15 85.55 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 124.4 1.08 . . . . 127.77 109.574 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -66.61 -39.4 88.34 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 122.799 0.44 . . . . 111.98 111.59 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.33 -41.5 98.61 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 123.924 0.89 . . . . 100.61 110.138 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.78 -44.29 93.85 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.996 0.918 . . . . 140.72999999999999 110.175 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.3 tp60 -62.49 -38.99 92.01 Favored 'General case' 0 C--N 1.347 0.471 0 C-N-CA 122.608 0.363 . . . . 147.78 110.424 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.5 -49.38 76.96 Favored 'General case' 0 C--N 1.354 0.769 0 C-N-CA 122.816 0.446 . . . . 94.069999999999993 111.543 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 60.8 mt -61.42 -30.8 70.79 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 123.506 0.722 . . . . 97.510000000000005 112.174 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -69.8 -56.2 7.78 Favored 'General case' 0 C--N 1.352 0.679 0 N-CA-C 108.907 -0.775 . . . . 142.15000000000001 108.907 176.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.4 mt -53.56 -38.82 64.25 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 125.008 1.323 . . . . 105.88 112.434 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -85.56 -7.33 10.89 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 124.13 0.972 . . . . 99.530000000000001 113.237 -177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 59.5 44.35 14.95 Favored 'General case' 0 C--N 1.36 1.062 0 C-N-CA 125.046 1.338 . . . . 109.06 111.815 179.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' ' 54' ' ' LEU . . . -66.55 -18.4 65.34 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 124.451 1.1 . . . . 105.04000000000001 111.253 179.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -69.49 -26.5 64.58 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 123.594 0.758 . . . . 126.95999999999999 111.787 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.2 -0.64 57.33 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 124.024 0.93 . . . . 129.47 112.909 -178.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 51' ' ' ALA . 3.5 mp -60.44 -27.07 67.21 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.812 0.671 . . . . 111.45999999999999 112.812 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 70.0 p -84.02 -19.27 34.75 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 114.992 1.478 . . . . 117.75 114.992 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 45.8 t -41.3 -45.38 7.01 Favored Pre-proline 0 CA--C 1.568 1.638 0 N-CA-C 114.308 1.225 . . . . 115.27 114.308 179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -57.23 -36.23 99.01 Favored 'Trans proline' 0 C--N 1.367 1.521 0 CA-C-N 121.041 1.407 . . . . 116.7 114.498 176.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.58 -42.87 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.295 0.638 . . . . 118.33 110.719 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -65.73 -36.92 84.97 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.75 0.82 . . . . 124.16 111.221 178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.45 68.38 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 123.767 0.827 . . . . 126.81 110.873 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -58.88 -43.32 90.92 Favored 'General case' 0 C--N 1.358 0.939 0 C-N-CA 123.906 0.882 . . . . 170.34 111.938 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.73 -33.85 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 122.67 0.388 . . . . 132.66 111.259 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -69.32 -42.4 75.43 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.669 0.788 . . . . 159.25999999999999 110.562 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . . . -71.25 -29.81 65.55 Favored 'General case' 0 C--N 1.36 1.063 0 C-N-CA 123.712 0.805 . . . . 150.03999999999999 111.36 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' MSE . . . . . . . . . . . . . 24.8 ttm -66.78 -38.91 87.47 Favored 'General case' 0 C--N 1.348 0.534 0 C-N-CA 125.084 1.354 . . . . 166.72999999999999 110.948 178.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.9 mt -71.92 -43.46 65.26 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 123.447 0.699 . . . . 154.06999999999999 111.485 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.85 76.95 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.044 0.538 . . . . 157.44 110.274 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.66 -36.9 73.6 Favored 'General case' 0 C--N 1.363 1.187 0 C-N-CA 124.72 1.208 . . . . 198.65000000000001 110.18 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 -72.88 -33.53 66.11 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.039 0.936 . . . . 191.94999999999999 109.354 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.413 ' HB2' HD13 ' A' ' 83' ' ' LEU . 53.8 t80 -66.48 -45.59 79.18 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 125.04 1.336 . . . . 171.87 109.759 178.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.02 -53.03 35.19 Favored 'General case' 0 C--N 1.35 0.602 0 C-N-CA 123.272 0.629 . . . . 176.44999999999999 109.737 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . . . -32.58 -40.3 0.05 OUTLIER 'General case' 0 C--N 1.37 1.497 0 C-N-CA 127.249 2.22 . . . . 182.03999999999999 115.637 -179.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -134.92 129.18 33.9 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.402 0.281 . . . . 187.66 110.785 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . . . 61.35 -89.07 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.976 1.71 . . . . 192.33000000000001 113.406 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 75.25 62.17 0.26 Allowed Pre-proline 0 CA--C 1.568 1.666 0 C-N-CA 127.411 2.284 . . . . 189.47 116.186 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -84.18 108.09 1.31 Allowed 'Trans proline' 0 C--N 1.366 1.454 0 CA-C-N 120.038 1.049 . . . . 191.19 110.726 176.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . . . -52.64 -10.69 0.16 Allowed 'General case' 0 C--N 1.362 1.136 0 N-CA-C 114.409 1.263 . . . . 181.50999999999999 114.409 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 79.0 p -77.44 -19.57 55.85 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 124.065 0.946 . . . . 188.78999999999999 109.862 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -114.99 37.22 3.55 Favored 'General case' 0 CA--C 1.561 1.394 0 C-N-CA 123.81 0.844 . . . . 205.25999999999999 112.863 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 21.6 mttt -76.39 -18.58 58.79 Favored 'General case' 0 C--N 1.353 0.75 0 C-N-CA 122.811 0.444 . . . . 168.93000000000001 111.134 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.33 -16.51 63.0 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 123.687 0.795 . . . . 162.61000000000001 111.139 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.1 t -76.62 -41.26 34.04 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 N-CA-C 107.736 -1.209 . . . . 164.90000000000001 107.736 174.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 70' ' ' PHE . 16.4 tp -65.47 -36.43 83.85 Favored 'General case' 0 C--N 1.362 1.133 0 C-N-CA 123.406 0.682 . . . . 157.30000000000001 109.672 175.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -54.37 -46.18 72.98 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 124.735 1.214 . . . . 195.93000000000001 111.953 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 11.3 ptt-85 -75.25 -36.72 61.23 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 112.717 0.636 . . . . 186.78 112.717 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 23.6 m-85 -67.94 -29.93 69.11 Favored 'General case' 0 C--N 1.347 0.497 0 CA-C-N 117.868 0.304 . . . . 146.97999999999999 111.608 177.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -76.15 -28.15 57.26 Favored 'General case' 0 C--N 1.35 0.593 0 C-N-CA 122.678 0.391 . . . . 151.99000000000001 110.08 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -74.86 -39.5 61.51 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.117 -0.697 . . . . 119.88 109.117 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -61.4 -48.7 80.02 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 124.888 1.275 . . . . 145.38999999999999 109.746 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -60.56 -38.43 84.53 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.29 1.036 . . . . 116.45999999999999 110.631 177.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -65.34 -41.43 93.92 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.509 0.723 . . . . 143.47999999999999 109.888 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.79 -35.26 76.81 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.536 0.734 . . . . 109.73999999999999 111.657 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -73.34 -32.72 64.71 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 123.465 0.706 . . . . 128.46000000000001 112.099 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 59.8 mt -73.34 -39.48 65.18 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 107.712 -1.218 . . . . 109.81 107.712 175.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -59.0 -30.8 68.25 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 122.923 0.489 . . . . 124.45999999999999 111.324 177.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -68.67 -43.54 75.93 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 123.306 0.642 . . . . 106.56999999999999 110.486 178.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -84.34 -57.85 2.99 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 112.598 0.592 . . . . 100.5 112.598 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 3.7 pt -117.38 26.46 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 116.194 1.924 . . . . 104.33 116.194 -172.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.67 152.59 51.59 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.34 -1.104 . . . . 98.670000000000002 110.34 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -52.43 -35.76 52.89 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.523 0.935 . . . . 97.810000000000002 113.523 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.96 -22.11 66.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.382 1.073 . . . . 119.66 112.253 178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -91.38 -37.57 13.14 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.078 0.551 . . . . 105.61 110.436 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 31.6 mm -75.73 -51.49 20.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 124.873 1.269 . . . . 103.55 111.637 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -42.15 -49.3 11.61 Favored Pre-proline 0 CA--C 1.554 1.107 0 N-CA-C 115.896 1.813 . . . . 135.81999999999999 115.896 -178.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -62.57 -37.31 59.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 CA-C-N 120.508 1.217 . . . . 102.48999999999999 114.07 -177.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.79 -23.54 42.07 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 113.537 0.94 . . . . 157.83000000000001 113.537 -177.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 37.1 mt -77.61 -31.81 53.12 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-O 119.668 -0.206 . . . . 97.150000000000006 110.553 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.55 -45.82 87.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.413 0 N-CA-C 108.279 -1.008 . . . . 97.900000000000006 108.279 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 113' ' ' THR . 63.8 mttt -57.07 -41.43 78.78 Favored 'General case' 0 C--N 1.358 0.935 0 N-CA-C 109.642 -0.503 . . . . 142.06 109.642 176.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.1 tp -59.13 -44.02 92.01 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.682 1.193 . . . . 100.61 112.582 178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -81.38 -39.11 25.5 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 114.755 1.391 . . . . 102.36 114.755 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 77.2 p -68.17 -28.66 67.48 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-O 119.306 -0.378 . . . . 100.34 111.407 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 109' ' ' LYS . 43.1 p -83.41 -23.89 32.16 Favored 'General case' 0 C--N 1.363 1.177 0 CA-C-O 119.312 -0.375 . . . . 113.28 111.888 179.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -99.09 -15.3 19.05 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 113.869 1.063 . . . . 106.20999999999999 113.869 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -136.05 152.3 50.75 Favored 'General case' 0 N--CA 1.462 0.127 0 C-N-CA 122.726 0.41 . . . . 97.519999999999996 111.52 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 17.4 p -82.83 163.37 21.22 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 107.429 -1.323 . . . . 98.560000000000002 107.429 176.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -58.08 -39.59 78.94 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.109 0.564 . . . . 125.13 109.689 177.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 54.6 p -67.98 -36.53 80.18 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 122.913 0.485 . . . . 105.95999999999999 111.757 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -67.75 -43.99 78.58 Favored 'General case' 0 C--N 1.365 1.243 0 CA-C-O 119.012 -0.518 . . . . 102.73 109.755 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 75.8 mt -63.27 -40.06 96.33 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 123.783 0.833 . . . . 95.950000000000003 111.052 177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -60.25 -44.73 95.02 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 124.336 1.054 . . . . 162.94999999999999 109.622 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -68.39 -34.49 76.13 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 124.853 1.261 . . . . 106.06 113.038 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 32.6 mt -65.85 -39.09 90.45 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 108.837 -0.801 . . . . 93.609999999999999 108.837 174.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -64.73 -41.81 95.69 Favored 'General case' 0 C--O 1.222 -0.387 0 C-N-CA 123.233 0.613 . . . . 100.06 111.391 176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.12 -43.77 98.37 Favored 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.622 0.769 . . . . 95.909999999999997 109.858 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -64.3 -51.19 64.72 Favored 'General case' 0 C--N 1.364 1.209 0 CA-C-O 118.778 -0.629 . . . . 98.349999999999994 112.078 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -74.09 -12.51 60.63 Favored 'General case' 0 C--N 1.348 0.501 0 N-CA-C 115.546 1.684 . . . . 117.29000000000001 115.546 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -82.87 -29.58 29.24 Favored 'General case' 0 C--N 1.348 0.518 0 N-CA-C 108.522 -0.918 . . . . 145.88 108.522 174.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 13.4 p -64.46 153.45 86.66 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.802 1.241 . . . . 98.400000000000006 112.376 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.401 ' HD2' 'CL ' ' A' ' 4' ' ' ' CL' . 51.5 Cg_exo -54.86 -36.7 92.14 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 113.886 0.687 . . . . 100.66 113.886 179.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.2 tp -70.05 -39.57 75.61 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 119.434 -0.317 . . . . 96.420000000000002 111.096 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -58.51 -47.57 89.18 Favored Glycine 0 C--O 1.237 0.298 0 N-CA-C 111.124 -0.79 . . . . 93.109999999999999 111.124 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 22.5 mttt -62.61 -36.62 83.35 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 123.778 0.831 . . . . 145.56999999999999 111.175 177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -65.83 -44.78 84.54 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 109.709 -0.478 . . . . 97.549999999999997 109.709 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 72.3 t -56.79 -51.29 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.13 0.572 . . . . 92.620000000000005 110.339 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 85.3 mt -54.41 -42.94 71.06 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 113.735 1.013 . . . . 94.510000000000005 113.735 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -72.53 -42.95 64.17 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 118.26 0.482 . . . . 160.25 111.611 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 32.9 mmtt -71.26 -40.99 70.65 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 113.831 1.049 . . . . 107.22 113.831 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' MSE . . . . . . . . . . . . 0.377 15.0 mmt -46.91 -50.66 43.77 Favored Pre-proline 0 C--N 1.355 0.818 0 N-CA-C 118.385 2.735 . . . . 131.33000000000001 118.385 -174.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -54.77 -46.35 33.99 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 CA-C-N 121.258 1.485 . . . . 113.40000000000001 113.685 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 29.0 ttp85 -70.12 -40.92 74.59 Favored 'General case' 0 C--N 1.357 0.907 0 N-CA-C 112.856 0.687 . . . . 138.84999999999999 112.856 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 51.7 mt -63.61 -39.04 93.36 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-O 119.371 -0.347 . . . . 100.66 111.044 177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 98.1 m -64.93 -46.5 81.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.621 0.768 . . . . 111.95 110.588 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.81 -46.37 88.25 Favored 'General case' 0 C--N 1.347 0.467 0 C-N-CA 124.229 1.012 . . . . 109.05 111.783 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -65.44 -38.39 89.73 Favored 'General case' 0 C--N 1.351 0.652 0 C-N-CA 123.428 0.691 . . . . 145.90000000000001 111.029 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 25.7 t -64.61 -40.99 96.47 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.254 1.422 . . . . 116.13 110.342 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.71 -32.12 62.05 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.708 0.803 . . . . 107.44 112.38 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -68.54 -40.7 80.61 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.893 -0.78 . . . . 160.02000000000001 108.893 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 2.8 tp -57.13 -54.06 51.04 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.023 1.729 . . . . 113.73999999999999 110.196 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 39.7 m -62.2 -46.96 86.58 Favored 'General case' 0 C--N 1.351 0.635 0 C-N-CA 124.072 0.949 . . . . 111.06999999999999 112.44 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -61.39 -37.68 84.32 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 122.737 0.415 . . . . 167.49000000000001 111.12 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -64.27 -47.07 80.98 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 122.609 0.364 . . . . 115.97 110.476 178.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -64.49 -41.48 96.44 Favored 'General case' 0 C--N 1.354 0.803 0 C-N-CA 125.01 1.324 . . . . 120.43000000000001 111.002 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 45.7 tp -59.9 -29.22 68.21 Favored 'General case' 0 C--N 1.36 1.028 0 C-N-CA 125.511 1.524 . . . . 112.20999999999999 112.967 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -64.07 -22.4 66.92 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.016 0.376 . . . . 165.34 112.016 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' GLY . . . . . . . . . . . . . . . -69.47 -24.29 76.19 Favored Glycine 0 C--N 1.34 0.78 0 O-C-N 123.72 0.637 . . . . 111.3 113.285 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -93.77 -1.07 55.52 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.624 0.769 . . . . 114.45 112.201 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 53.4 t -63.88 -56.27 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.101 0.56 . . . . 121.68000000000001 112.469 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -59.68 -48.61 94.92 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-O 117.819 -1.086 . . . . 170.83000000000001 111.988 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -63.03 -37.83 50.34 Favored 'Trans proline' 0 C--N 1.374 1.902 0 CA-C-N 120.824 1.33 . . . . 119.20999999999999 114.453 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 49.0 t -70.49 -33.49 53.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 118.343 0.519 . . . . 124.09 110.377 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -66.21 -45.81 79.43 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 123.067 0.547 . . . . 147.5 109.619 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' LYS . . . . . . . . . . . . . 9.6 tptp -62.51 -40.91 98.27 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 125.646 1.579 . . . . 133.96000000000001 109.305 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.71 -51.79 68.46 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.447 1.899 . . . . 137.34 112.3 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' MSE . . . . . . . . . . . . . 83.8 mtp -65.86 -39.58 90.86 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.223 0.609 . . . . 153.36000000000001 110.955 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.39 -37.86 84.96 Favored 'General case' 0 C--N 1.355 0.846 0 C-N-CA 124.789 1.236 . . . . 148.08000000000001 110.648 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 95.5 m-20 -70.01 -37.68 75.73 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.956 0.902 . . . . 149.86000000000001 110.926 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' MSE . . . . . . . . . . . . . 41.2 ttp -68.11 -41.6 81.5 Favored 'General case' 0 C--N 1.36 1.048 0 CA-C-N 118.255 0.48 . . . . 150.16 110.046 177.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ASP . . . . . . . . . . . . . . . -63.62 -36.08 82.63 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 123.539 0.735 . . . . 159.25 109.527 175.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -66.1 -47.86 72.82 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 123.552 0.741 . . . . 194.28999999999999 109.936 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -64.16 -38.89 92.68 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 125.267 1.427 . . . . 177.68000000000001 113.274 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 24.7 mt -83.62 -3.85 58.08 Favored 'General case' 0 CA--C 1.557 1.228 0 N-CA-C 112.34 0.496 . . . . 173.87 112.34 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' GLY . . . . . . . . . . . . . . . 76.37 65.91 1.93 Allowed Glycine 0 C--N 1.339 0.723 0 C-N-CA 123.865 0.745 . . . . 182.25 113.656 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 15.0 t -126.83 127.6 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.186 0.995 . . . . 181.31 110.005 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.386 0 C-N-CA 126.255 1.822 . . . . 224.75999999999999 113.376 -179.627 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' CL' . . . . . 0.401 'CL ' ' HD2' ' A' ' 130' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_