data_6nuj_residue ############################ # Computer software used # ############################ 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 6nuj _Structure_validation_residue.Date_analyzed 2019-12-06 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 ' 57' ' ' SER . . . . . . . . . . . . . 62.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.479 0.18 . . . . 74.19 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -75.2 -8.05 19.51 Favored 'Trans proline' 0 C--O 1.24 0.577 0 O-C-N 122.76 0.873 . . . . 43.36 114.211 -175.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.51 5.98 67.7 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 115.517 0.967 . . . . 27.83 115.517 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.9 mt -96.05 126.24 48.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 118.798 1.299 . . . . 47.8 109.15 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -123.69 153.71 40.44 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.65 0.78 . . . . 27.06 109.973 173.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -122.27 132.99 54.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.181 -0.674 . . . . 39.38 109.181 172.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 mp -121.04 132.88 55.16 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.246 -0.65 . . . . 39.67 109.246 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -147.1 155.0 41.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.37 -0.974 . . . . 25.72 108.37 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.3 p -122.27 150.15 42.73 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.605 -1.998 . . . . 53.47 105.605 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -110.87 137.92 47.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 50.68 110.151 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -155.89 131.47 9.66 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.08 -1.082 . . . . 41.21 108.08 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . 0.487 ' OE2' ' NE ' ' A' ' 166' ' ' ARG . 74.3 mt-10 57.45 36.33 26.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.304 0.573 . . . . 35.42 111.367 174.317 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.47 8.08 59.0 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 115.265 0.866 . . . . 36.36 115.265 -178.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -115.1 171.82 7.44 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.427 1.114 . . . . 52.09 109.827 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.95 129.73 73.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 115.331 -0.85 . . . . 28.35 108.72 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.21 119.45 60.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 107.165 -1.42 . . . . 25.32 107.165 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.8 tt -92.04 122.54 34.64 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.069 -1.086 . . . . 40.84 108.069 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.2 t -118.28 123.53 71.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.505 -0.924 . . . . 22.46 108.505 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.8 132.24 54.33 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.344 -0.984 . . . . 27.53 108.344 172.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 44.1 t -120.57 126.35 75.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.817 -0.809 . . . . 25.43 108.817 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -76.99 111.72 12.85 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.44 -1.319 . . . . 27.36 107.44 168.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 79.2 t -63.41 -40.02 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.881 0.372 . . . . 29.86 110.919 -163.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.6 63.47 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.158 -0.617 . . . . 35.55 112.147 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.8 p -111.29 -23.28 10.91 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.358 1.244 . . . . 26.62 114.358 -173.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.07 -0.01 89.1 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.292 0.877 . . . . 24.93 115.292 -169.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -63.98 140.14 58.84 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.388 1.094 . . . . 39.82 110.432 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 65.8 mt -121.04 143.81 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 116.058 -0.519 . . . . 26.89 110.203 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -125.12 140.71 52.64 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.708 -1.219 . . . . 29.47 107.708 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -145.4 161.2 40.24 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.189 -1.005 . . . . 28.07 110.88 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -150.1 140.52 22.38 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.573 -1.64 . . . . 42.94 106.573 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.0 t -89.37 125.61 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.086 -0.709 . . . . 27.03 109.086 168.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 33.4 pt -118.96 153.93 52.92 Favored Pre-proline 0 C--O 1.24 0.56 0 N-CA-C 107.918 -1.141 . . . . 37.81 107.918 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -67.73 -41.06 8.77 Favored 'Trans proline' 0 C--O 1.238 0.497 0 CA-C-N 119.465 0.845 . . . . 57.13 112.939 -175.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -148.03 161.2 41.86 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.421 0.629 . . . . 52.96 109.47 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -73.54 106.87 5.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.152 -0.931 . . . . 59.57 109.348 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -139.13 156.25 47.28 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.52 0.676 . . . . 39.8 109.584 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.19 -35.9 89.16 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-N 115.083 -0.962 . . . . 28.52 113.041 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -60.48 -44.41 95.94 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.293 -0.534 . . . . 47.66 111.474 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.4 -42.05 88.4 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.752 -0.779 . . . . 44.05 110.483 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -61.86 -44.33 97.04 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 21.64 110.634 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.3 -43.98 97.97 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.843 -0.343 . . . . 19.99 111.006 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -64.13 -43.35 95.55 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.553 -0.459 . . . . 23.31 110.568 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -58.68 -43.8 90.05 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 121.038 -0.265 . . . . 21.74 111.537 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.0 mt -62.3 -38.75 90.58 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.545 -0.462 . . . . 21.48 111.519 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.16 -41.28 98.15 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.046 -0.662 . . . . 26.31 111.095 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -67.51 -46.21 73.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.48 -0.488 . . . . 38.2 111.082 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.8 tp -57.28 -45.93 83.61 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.796 0.331 . . . . 17.97 111.282 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.43 -26.11 66.25 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.061 0.393 . . . . 17.17 112.061 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -75.9 -14.5 82.12 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.077 -1.059 . . . . 20.85 114.536 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -102.44 -39.05 7.31 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.132 0.973 . . . . 60.24 112.451 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -127.15 160.28 60.54 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 124.254 1.021 . . . . 28.05 109.299 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.19 85.87 1.61 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 CA-C-O 121.553 0.564 . . . . 27.77 111.302 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.2 t -85.55 112.77 22.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.396 -0.965 . . . . 28.66 108.396 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -102.52 -43.49 5.62 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.544 0.572 . . . . 69.93 112.544 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 60.7 p -137.72 151.72 48.5 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.355 -0.609 . . . . 35.36 109.355 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.0 t -130.15 134.6 62.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.134 -1.062 . . . . 28.7 108.134 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -112.6 167.86 10.12 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.851 0.861 . . . . 42.71 109.532 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -158.37 156.7 30.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.362 -0.977 . . . . 22.85 108.362 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -88.45 -4.9 58.54 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.423 -0.808 . . . . 43.03 113.117 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -131.58 94.21 3.48 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 107.023 -1.473 . . . . 28.31 107.023 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.55 -32.43 68.92 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.613 -0.803 . . . . 19.83 113.772 -173.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 62.9 p -61.31 -18.13 57.04 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.387 0.594 . . . . 24.27 112.576 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -50.77 -29.78 12.41 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.742 0.645 . . . . 33.62 112.742 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -108.59 17.53 21.89 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.064 0.764 . . . . 32.4 113.064 -165.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.8 p -90.75 -15.28 30.48 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.32 0.859 . . . . 44.43 113.32 -172.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.4 p -71.78 155.74 40.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.642 0.734 . . . . 36.39 109.926 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 60.9 m -59.7 -34.78 73.33 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.618 -0.719 . . . . 37.49 111.806 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.1 p -69.04 -43.3 74.97 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.855 -0.338 . . . . 28.71 111.642 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.9 -46.9 95.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.093 0.473 . . . . 22.41 110.409 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -57.71 -38.65 75.61 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.025 -0.422 . . . . 51.93 111.623 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.95 86.94 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.568 -0.453 . . . . 18.76 112.041 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.8 -46.47 78.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.507 0.558 . . . . 15.86 112.507 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -61.3 -49.39 77.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.86 0.362 . . . . 27.63 110.512 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -65.63 -40.23 92.3 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.834 -0.621 . . . . 21.57 111.567 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -86.27 -1.68 57.7 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.109 0.781 . . . . 26.18 113.109 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 70.81 32.18 66.9 Favored Glycine 0 N--CA 1.452 -0.263 0 N-CA-C 114.804 0.681 . . . . 23.13 114.804 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 62.6 mt -93.93 132.92 36.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 117.673 0.736 . . . . 34.42 109.065 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -108.73 160.5 15.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.296 -0.631 . . . . 76.74 109.296 174.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.245 -0.582 . . . . 55.27 111.42 177.764 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.747 0.308 . . . . 72.18 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 11.8 mtp -57.67 -38.19 74.69 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.97 -0.559 . . . . 74.42 111.166 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -59.06 -39.69 82.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.297 -0.561 . . . . 68.06 110.902 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -70.32 -40.56 74.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.092 -0.643 . . . . 89.07 110.54 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -52.82 -47.92 67.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.889 0.376 . . . . 83.31 111.551 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.74 -43.66 98.41 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.246 -0.582 . . . . 49.71 111.741 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -62.03 -35.1 77.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.847 -0.741 . . . . 89.04 111.619 175.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -60.79 -48.35 82.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.284 -0.567 . . . . 56.58 111.148 175.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.48 -43.31 96.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 120.487 -0.485 . . . . 32.7 110.583 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 90.7 mt -53.65 -49.66 55.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-O 121.307 0.575 . . . . 28.19 110.178 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -58.26 -36.31 82.36 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.399 -0.905 . . . . 31.95 112.902 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -71.21 -31.82 68.08 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.849 -0.74 . . . . 49.23 112.221 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 20.5 m -102.61 -0.26 10.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 113.488 0.922 . . . . 35.86 113.488 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ARG . . . . . 0.487 ' NE ' ' OE2' ' A' ' 69' ' ' GLU . 52.3 tpt85 -61.29 -39.96 92.38 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.92 0.782 . . . . 34.52 112.187 -168.297 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -72.84 -13.26 61.25 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.866 0.691 . . . . 65.72 112.866 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -80.58 -12.34 59.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 113.679 0.992 . . . . 57.17 113.679 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -124.4 147.92 47.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.69 0.677 . . . . 32.99 111.2 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -68.52 -50.46 51.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.363 -0.835 . . . . 47.25 111.197 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -100.19 140.22 34.73 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.001 -0.437 . . . . 32.34 110.015 -172.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.4 tp -53.81 -40.07 66.07 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.801 -0.636 . . . . 27.9 111.719 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -60.85 -35.5 76.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.583 -0.447 . . . . 34.08 111.235 -175.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.1 m -66.37 -45.5 79.92 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 18.93 110.502 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.8 85.88 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.296 -0.561 . . . . 23.17 110.943 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.63 -47.21 91.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.005 0.431 . . . . 18.31 110.837 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -70.46 -33.08 70.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.139 -1.024 . . . . 18.37 111.137 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 87.6 mtp -59.0 -44.03 91.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.186 -0.606 . . . . 21.92 110.296 171.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -66.55 -40.03 88.86 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.437 -0.505 . . . . 21.04 111.073 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.8 t -61.56 -44.9 99.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.122 0.487 . . . . 18.31 110.132 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.24 -47.4 83.67 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.075 -0.391 . . . . 23.8 110.803 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.88 -46.41 96.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.102 0.477 . . . . 26.45 110.387 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.86 -47.33 86.85 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.081 -0.387 . . . . 28.05 111.413 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -73.73 -19.26 60.84 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.593 0.59 . . . . 23.25 112.593 -172.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -107.88 -1.7 20.52 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.155 0.798 . . . . 48.13 113.155 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -77.44 138.8 39.46 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.421 0.555 . . . . 56.49 110.528 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ARG . . . . . 0.453 ' NH2' ' OE2' ' A' ' 198' ' ' GLU . 95.7 mtt180 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.555 . . . . 76.05 110.658 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 108.694 -0.854 . . . . 87.26 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 76.8 p -88.09 163.72 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.041 -0.664 . . . . 33.16 109.54 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.15 -39.47 90.19 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.549 -0.86 . . . . 30.22 111.26 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -64.16 -38.4 95.89 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 120.194 -1.003 . . . . 28.68 112.639 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . 0.453 ' OE2' ' NH2' ' A' ' 187' ' ' ARG . 90.3 mt-10 -67.37 -40.42 85.74 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.257 -0.555 . . . . 43.41 111.624 174.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -66.37 -42.41 88.02 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.966 -0.694 . . . . 49.61 112.117 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 18.8 tt -63.05 -43.98 99.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 119.265 -0.974 . . . . 23.27 111.212 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.64 -37.04 78.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 118.871 -1.132 . . . . 32.7 110.254 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.98 -47.82 81.53 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.961 -0.462 . . . . 53.43 110.898 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.72 -45.61 94.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.017 0.437 . . . . 35.72 110.522 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 39.2 mm -71.4 -42.86 73.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.298 -0.561 . . . . 36.81 110.608 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.07 95.29 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.908 -0.495 . . . . 41.44 111.121 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 92.1 m -58.59 -39.36 80.16 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.711 -0.396 . . . . 47.73 111.355 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -66.84 -26.31 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.387 -0.525 . . . . 56.72 111.721 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 63.42 110.465 178.974 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' L3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.479 0.18 . . . . 74.19 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -75.2 -8.05 19.51 Favored 'Trans proline' 0 C--O 1.24 0.577 0 O-C-N 122.76 0.873 . . . . 43.36 114.211 -175.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.51 5.98 67.7 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 115.517 0.967 . . . . 27.83 115.517 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.9 mt -96.05 126.24 48.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 118.798 1.299 . . . . 47.8 109.15 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -123.69 153.71 40.44 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.65 0.78 . . . . 27.06 109.973 173.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -122.27 132.99 54.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.181 -0.674 . . . . 39.38 109.181 172.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 mp -121.04 132.88 55.16 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.246 -0.65 . . . . 39.67 109.246 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -147.1 155.0 41.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.37 -0.974 . . . . 25.72 108.37 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.3 p -122.27 150.15 42.73 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.605 -1.998 . . . . 53.47 105.605 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -110.87 137.92 47.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 50.68 110.151 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -155.89 131.47 9.66 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.08 -1.082 . . . . 41.21 108.08 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 57.45 36.33 26.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.304 0.573 . . . . 35.42 111.367 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.47 8.08 59.0 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 115.265 0.866 . . . . 36.36 115.265 -178.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -115.1 171.82 7.44 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.427 1.114 . . . . 52.09 109.827 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.95 129.73 73.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 115.331 -0.85 . . . . 28.35 108.72 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.21 119.45 60.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 107.165 -1.42 . . . . 25.32 107.165 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.8 tt -92.04 122.54 34.64 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.069 -1.086 . . . . 40.84 108.069 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.2 t -118.28 123.53 71.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.505 -0.924 . . . . 22.46 108.505 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.8 132.24 54.33 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.344 -0.984 . . . . 27.53 108.344 172.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . 0.418 HG22 HG12 ' A' ' 84' ' ' ILE . 44.1 t -120.57 126.35 75.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.817 -0.809 . . . . 25.43 108.817 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -76.99 111.72 12.85 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.44 -1.319 . . . . 27.36 107.44 168.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 79.2 t -63.41 -40.02 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.881 0.372 . . . . 29.86 110.919 -163.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.6 63.47 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.158 -0.617 . . . . 35.55 112.147 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.8 p -111.29 -23.28 10.91 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.358 1.244 . . . . 26.62 114.358 -173.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.07 -0.01 89.1 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.292 0.877 . . . . 24.93 115.292 -169.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -63.98 140.14 58.84 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.388 1.094 . . . . 39.82 110.432 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 77' ' ' VAL . 65.8 mt -121.04 143.81 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 116.058 -0.519 . . . . 26.89 110.203 -177.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -125.12 140.71 52.64 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.708 -1.219 . . . . 29.47 107.708 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -145.4 161.2 40.24 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.189 -1.005 . . . . 28.07 110.88 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -150.1 140.52 22.38 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.573 -1.64 . . . . 42.94 106.573 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.0 t -89.37 125.61 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.086 -0.709 . . . . 27.03 109.086 168.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 33.4 pt -118.96 153.93 52.92 Favored Pre-proline 0 C--O 1.24 0.56 0 N-CA-C 107.918 -1.141 . . . . 37.81 107.918 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -67.73 -41.06 8.77 Favored 'Trans proline' 0 C--O 1.238 0.497 0 CA-C-N 119.465 0.845 . . . . 57.13 112.939 -175.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -148.03 161.2 41.86 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.421 0.629 . . . . 52.96 109.47 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -73.54 106.87 5.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.152 -0.931 . . . . 59.57 109.348 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -139.13 156.25 47.28 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.52 0.676 . . . . 39.8 109.584 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.19 -35.9 89.16 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-N 115.083 -0.962 . . . . 28.52 113.041 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -60.48 -44.41 95.94 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.293 -0.534 . . . . 47.66 111.474 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.4 -42.05 88.4 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.752 -0.779 . . . . 44.05 110.483 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -61.86 -44.33 97.04 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 21.64 110.634 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.3 -43.98 97.97 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.843 -0.343 . . . . 19.99 111.006 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -64.13 -43.35 95.55 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.553 -0.459 . . . . 23.31 110.568 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -58.68 -43.8 90.05 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 121.038 -0.265 . . . . 21.74 111.537 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.0 mt -62.3 -38.75 90.58 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.545 -0.462 . . . . 21.48 111.519 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.16 -41.28 98.15 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.046 -0.662 . . . . 26.31 111.095 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -67.51 -46.21 73.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.48 -0.488 . . . . 38.2 111.082 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.8 tp -57.28 -45.93 83.61 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.796 0.331 . . . . 17.97 111.282 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.43 -26.11 66.25 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.061 0.393 . . . . 17.17 112.061 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -75.9 -14.5 82.12 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.077 -1.059 . . . . 20.85 114.536 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -102.44 -39.05 7.31 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.132 0.973 . . . . 60.24 112.451 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -127.15 160.28 60.54 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 124.254 1.021 . . . . 28.05 109.299 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.19 85.87 1.61 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 CA-C-O 121.553 0.564 . . . . 27.77 111.302 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.2 t -85.55 112.77 22.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.396 -0.965 . . . . 28.66 108.396 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -102.52 -43.49 5.62 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.544 0.572 . . . . 69.93 112.544 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 136' ' ' LYS . 60.7 p -137.72 151.72 48.5 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.355 -0.609 . . . . 35.36 109.355 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.0 t -130.15 134.6 62.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.134 -1.062 . . . . 28.7 108.134 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -112.6 167.86 10.12 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.851 0.861 . . . . 42.71 109.532 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -158.37 156.7 30.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.362 -0.977 . . . . 22.85 108.362 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -88.45 -4.9 58.54 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.423 -0.808 . . . . 43.03 113.117 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -131.58 94.21 3.48 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 107.023 -1.473 . . . . 28.31 107.023 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.55 -32.43 68.92 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.613 -0.803 . . . . 19.83 113.772 -173.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 62.9 p -61.31 -18.13 57.04 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.387 0.594 . . . . 24.27 112.576 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -50.77 -29.78 12.41 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.742 0.645 . . . . 33.62 112.742 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -108.59 17.53 21.89 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.064 0.764 . . . . 32.4 113.064 -165.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.8 p -90.75 -15.28 30.48 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.32 0.859 . . . . 44.43 113.32 -172.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.4 p -71.78 155.74 40.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.642 0.734 . . . . 36.39 109.926 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 60.9 m -59.7 -34.78 73.33 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.618 -0.719 . . . . 37.49 111.806 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.1 p -69.04 -43.3 74.97 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.855 -0.338 . . . . 28.71 111.642 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.9 -46.9 95.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.093 0.473 . . . . 22.41 110.409 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -57.71 -38.65 75.61 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.025 -0.422 . . . . 51.93 111.623 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.95 86.94 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.568 -0.453 . . . . 18.76 112.041 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.8 -46.47 78.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.507 0.558 . . . . 15.86 112.507 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -61.3 -49.39 77.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.86 0.362 . . . . 27.63 110.512 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -65.63 -40.23 92.3 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.834 -0.621 . . . . 21.57 111.567 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -86.27 -1.68 57.7 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.109 0.781 . . . . 26.18 113.109 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 70.81 32.18 66.9 Favored Glycine 0 N--CA 1.452 -0.263 0 N-CA-C 114.804 0.681 . . . . 23.13 114.804 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 62.6 mt -93.93 132.92 36.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 117.673 0.736 . . . . 34.42 109.065 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 112' ' ' THR . 99.1 mttt -108.73 160.5 15.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.296 -0.631 . . . . 76.74 109.296 174.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.245 -0.582 . . . . 55.27 111.42 177.764 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.747 0.308 . . . . 72.18 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 11.8 mtp -57.67 -38.19 74.69 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.97 -0.559 . . . . 74.42 111.166 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -59.06 -39.69 82.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.297 -0.561 . . . . 68.06 110.902 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -70.32 -40.56 74.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.092 -0.643 . . . . 89.07 110.54 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -52.82 -47.92 67.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.889 0.376 . . . . 83.31 111.551 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.74 -43.66 98.41 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.246 -0.582 . . . . 49.71 111.741 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -62.03 -35.1 77.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.847 -0.741 . . . . 89.04 111.619 175.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -60.79 -48.35 82.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.284 -0.567 . . . . 56.58 111.148 175.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.48 -43.31 96.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 120.487 -0.485 . . . . 32.7 110.583 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 90.7 mt -53.65 -49.66 55.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-O 121.307 0.575 . . . . 28.19 110.178 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -58.26 -36.31 82.36 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.399 -0.905 . . . . 31.95 112.902 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -71.21 -31.82 68.08 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.849 -0.74 . . . . 49.23 112.221 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 20.5 m -102.61 -0.26 10.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 113.488 0.922 . . . . 35.86 113.488 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 52.3 tpt85 -61.29 -39.96 92.38 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.92 0.782 . . . . 34.52 112.187 -168.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -72.84 -13.26 61.25 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.866 0.691 . . . . 65.72 112.866 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -80.58 -12.34 59.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 113.679 0.992 . . . . 57.17 113.679 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -124.4 147.92 47.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.69 0.677 . . . . 32.99 111.2 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -68.52 -50.46 51.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.363 -0.835 . . . . 47.25 111.197 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -100.19 140.22 34.73 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.001 -0.437 . . . . 32.34 110.015 -172.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.4 tp -53.81 -40.07 66.07 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.801 -0.636 . . . . 27.9 111.719 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -60.85 -35.5 76.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.583 -0.447 . . . . 34.08 111.235 -175.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.1 m -66.37 -45.5 79.92 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 18.93 110.502 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.8 85.88 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.296 -0.561 . . . . 23.17 110.943 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.63 -47.21 91.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.005 0.431 . . . . 18.31 110.837 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -70.46 -33.08 70.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.139 -1.024 . . . . 18.37 111.137 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 87.6 mtp -59.0 -44.03 91.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.186 -0.606 . . . . 21.92 110.296 171.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -66.55 -40.03 88.86 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.437 -0.505 . . . . 21.04 111.073 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.8 t -61.56 -44.9 99.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.122 0.487 . . . . 18.31 110.132 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.24 -47.4 83.67 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.075 -0.391 . . . . 23.8 110.803 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.88 -46.41 96.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.102 0.477 . . . . 26.45 110.387 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.86 -47.33 86.85 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.081 -0.387 . . . . 28.05 111.413 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -73.73 -19.26 60.84 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.593 0.59 . . . . 23.25 112.593 -172.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -107.88 -1.7 20.52 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.155 0.798 . . . . 48.13 113.155 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -77.44 138.8 39.46 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.421 0.555 . . . . 56.49 110.528 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.555 . . . . 76.05 110.658 175.775 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 108.694 -0.854 . . . . 87.26 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 76.8 p -88.09 163.72 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.041 -0.664 . . . . 33.16 109.54 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.15 -39.47 90.19 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.549 -0.86 . . . . 30.22 111.26 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -64.16 -38.4 95.89 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 120.194 -1.003 . . . . 28.68 112.639 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -67.37 -40.42 85.74 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.257 -0.555 . . . . 43.41 111.624 174.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -66.37 -42.41 88.02 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.966 -0.694 . . . . 49.61 112.117 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 18.8 tt -63.05 -43.98 99.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 119.265 -0.974 . . . . 23.27 111.212 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.64 -37.04 78.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 118.871 -1.132 . . . . 32.7 110.254 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.98 -47.82 81.53 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.961 -0.462 . . . . 53.43 110.898 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.72 -45.61 94.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.017 0.437 . . . . 35.72 110.522 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 39.2 mm -71.4 -42.86 73.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.298 -0.561 . . . . 36.81 110.608 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.07 95.29 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.908 -0.495 . . . . 41.44 111.121 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 92.1 m -58.59 -39.36 80.16 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.711 -0.396 . . . . 47.73 111.355 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -66.84 -26.31 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.387 -0.525 . . . . 56.72 111.721 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 63.42 110.465 178.974 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' L3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 62.0 m . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.479 0.18 . . . . 74.19 111.074 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -75.2 -8.05 19.51 Favored 'Trans proline' 0 C--O 1.24 0.577 0 O-C-N 122.76 0.873 . . . . 43.36 114.211 -175.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -95.51 5.98 67.7 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 115.517 0.967 . . . . 27.83 115.517 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.9 mt -96.05 126.24 48.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-N 118.798 1.299 . . . . 47.8 109.15 -173.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -123.69 153.71 40.44 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.65 0.78 . . . . 27.06 109.973 173.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -122.27 132.99 54.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.181 -0.674 . . . . 39.38 109.181 172.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.2 mp -121.04 132.88 55.16 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 109.246 -0.65 . . . . 39.67 109.246 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -147.1 155.0 41.82 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.37 -0.974 . . . . 25.72 108.37 176.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 81.3 p -122.27 150.15 42.73 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.605 -1.998 . . . . 53.47 105.605 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -110.87 137.92 47.9 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.915 0.388 . . . . 50.68 110.151 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -155.89 131.47 9.66 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 108.08 -1.082 . . . . 41.21 108.08 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 57.45 36.33 26.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.304 0.573 . . . . 35.42 111.367 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 69.47 8.08 59.0 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 115.265 0.866 . . . . 36.36 115.265 -178.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.1 mttp -115.1 171.82 7.44 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.427 1.114 . . . . 52.09 109.827 177.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 97.2 t -117.95 129.73 73.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 115.331 -0.85 . . . . 28.35 108.72 -173.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.21 119.45 60.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 107.165 -1.42 . . . . 25.32 107.165 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.8 tt -92.04 122.54 34.64 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 108.069 -1.086 . . . . 40.84 108.069 175.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 93.2 t -118.28 123.53 71.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.505 -0.924 . . . . 22.46 108.505 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -109.8 132.24 54.33 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.344 -0.984 . . . . 27.53 108.344 172.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.418 HG22 HG12 ' A' ' 84' ' ' ILE . 44.1 t -120.57 126.35 75.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 108.817 -0.809 . . . . 25.43 108.817 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 -76.99 111.72 12.85 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.44 -1.319 . . . . 27.36 107.44 168.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 79.2 t -63.41 -40.02 87.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-O 120.881 0.372 . . . . 29.86 110.919 -163.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.71 -26.6 63.47 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.158 -0.617 . . . . 35.55 112.147 -173.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.8 p -111.29 -23.28 10.91 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 114.358 1.244 . . . . 26.62 114.358 -173.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.07 -0.01 89.1 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 115.292 0.877 . . . . 24.93 115.292 -169.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -63.98 140.14 58.84 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.388 1.094 . . . . 39.82 110.432 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.418 HG12 HG22 ' A' ' 77' ' ' VAL . 65.8 mt -121.04 143.81 32.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 116.058 -0.519 . . . . 26.89 110.203 -177.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -125.12 140.71 52.64 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.708 -1.219 . . . . 29.47 107.708 161.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -145.4 161.2 40.24 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.189 -1.005 . . . . 28.07 110.88 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -150.1 140.52 22.38 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.573 -1.64 . . . . 42.94 106.573 -177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 55.0 t -89.37 125.61 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 N-CA-C 109.086 -0.709 . . . . 27.03 109.086 168.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 33.4 pt -118.96 153.93 52.92 Favored Pre-proline 0 C--O 1.24 0.56 0 N-CA-C 107.918 -1.141 . . . . 37.81 107.918 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -67.73 -41.06 8.77 Favored 'Trans proline' 0 C--O 1.238 0.497 0 CA-C-N 119.465 0.845 . . . . 57.13 112.939 -175.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -148.03 161.2 41.86 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.421 0.629 . . . . 52.96 109.47 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -73.54 106.87 5.51 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.152 -0.931 . . . . 59.57 109.348 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 73.1 p -139.13 156.25 47.28 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.52 0.676 . . . . 39.8 109.584 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.19 -35.9 89.16 Favored Glycine 0 C--N 1.336 0.552 0 CA-C-N 115.083 -0.962 . . . . 28.52 113.041 175.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -60.48 -44.41 95.94 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 122.293 -0.534 . . . . 47.66 111.474 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.4 -42.05 88.4 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.752 -0.779 . . . . 44.05 110.483 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -61.86 -44.33 97.04 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.517 -0.473 . . . . 21.64 110.634 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.3 -43.98 97.97 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.843 -0.343 . . . . 19.99 111.006 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -64.13 -43.35 95.55 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.553 -0.459 . . . . 23.31 110.568 -178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -58.68 -43.8 90.05 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 121.038 -0.265 . . . . 21.74 111.537 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.0 mt -62.3 -38.75 90.58 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.545 -0.462 . . . . 21.48 111.519 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.16 -41.28 98.15 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.046 -0.662 . . . . 26.31 111.095 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -67.51 -46.21 73.55 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.48 -0.488 . . . . 38.2 111.082 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 20.8 tp -57.28 -45.93 83.61 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 120.796 0.331 . . . . 17.97 111.282 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -67.43 -26.11 66.25 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 112.061 0.393 . . . . 17.17 112.061 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -75.9 -14.5 82.12 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.077 -1.059 . . . . 20.85 114.536 177.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -102.44 -39.05 7.31 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.132 0.973 . . . . 60.24 112.451 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -127.15 160.28 60.54 Favored Pre-proline 0 C--N 1.324 -0.501 0 C-N-CA 124.254 1.021 . . . . 28.05 109.299 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -82.19 85.87 1.61 Allowed 'Trans proline' 0 C--O 1.234 0.31 0 CA-C-O 121.553 0.564 . . . . 27.77 111.302 176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.2 t -85.55 112.77 22.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 108.396 -0.965 . . . . 28.66 108.396 -174.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 51.6 mtpt -102.52 -43.49 5.62 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.544 0.572 . . . . 69.93 112.544 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 136' ' ' LYS . 60.7 p -137.72 151.72 48.5 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.355 -0.609 . . . . 35.36 109.355 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.0 t -130.15 134.6 62.44 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 N-CA-C 108.134 -1.062 . . . . 28.7 108.134 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -112.6 167.86 10.12 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.851 0.861 . . . . 42.71 109.532 174.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 9.9 t -158.37 156.7 30.96 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.362 -0.977 . . . . 22.85 108.362 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -88.45 -4.9 58.54 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.423 -0.808 . . . . 43.03 113.117 173.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.5 t-20 -131.58 94.21 3.48 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 107.023 -1.473 . . . . 28.31 107.023 176.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.55 -32.43 68.92 Favored Glycine 0 C--N 1.337 0.619 0 C-N-CA 120.613 -0.803 . . . . 19.83 113.772 -173.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 62.9 p -61.31 -18.13 57.04 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 117.387 0.594 . . . . 24.27 112.576 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -50.77 -29.78 12.41 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.742 0.645 . . . . 33.62 112.742 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 17.1 m-30 -108.59 17.53 21.89 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 113.064 0.764 . . . . 32.4 113.064 -165.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 75.8 p -90.75 -15.28 30.48 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.32 0.859 . . . . 44.43 113.32 -172.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.4 p -71.78 155.74 40.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.642 0.734 . . . . 36.39 109.926 -170.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 60.9 m -59.7 -34.78 73.33 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.618 -0.719 . . . . 37.49 111.806 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 36.1 p -69.04 -43.3 74.97 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.855 -0.338 . . . . 28.71 111.642 -175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.2 t -62.9 -46.9 95.15 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 121.093 0.473 . . . . 22.41 110.409 177.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.7 mttt -57.71 -38.65 75.61 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.025 -0.422 . . . . 51.93 111.623 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -66.99 -38.95 86.94 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.568 -0.453 . . . . 18.76 112.041 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -65.8 -46.47 78.54 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.507 0.558 . . . . 15.86 112.507 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' CAF . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 58.0 t90 -61.3 -49.39 77.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.86 0.362 . . . . 27.63 110.512 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -65.63 -40.23 92.3 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.834 -0.621 . . . . 21.57 111.567 -174.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -86.27 -1.68 57.7 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.109 0.781 . . . . 26.18 113.109 -176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 70.81 32.18 66.9 Favored Glycine 0 N--CA 1.452 -0.263 0 N-CA-C 114.804 0.681 . . . . 23.13 114.804 -179.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 62.6 mt -93.93 132.92 36.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 117.673 0.736 . . . . 34.42 109.065 -179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.424 ' O ' ' HA ' ' A' ' 112' ' ' THR . 99.1 mttt -108.73 160.5 15.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.296 -0.631 . . . . 76.74 109.296 174.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 . . . . . 0 C--N 1.329 -0.322 0 C-N-CA 120.245 -0.582 . . . . 55.27 111.42 177.764 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.747 0.308 . . . . 72.18 110.636 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 11.8 mtp -57.67 -38.19 74.69 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.97 -0.559 . . . . 74.42 111.166 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -59.06 -39.69 82.85 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.297 -0.561 . . . . 68.06 110.902 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -70.32 -40.56 74.1 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.092 -0.643 . . . . 89.07 110.54 177.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -52.82 -47.92 67.32 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.889 0.376 . . . . 83.31 111.551 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 23.8 tp -61.74 -43.66 98.41 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.246 -0.582 . . . . 49.71 111.741 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -62.03 -35.1 77.58 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.847 -0.741 . . . . 89.04 111.619 175.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 23.4 ttpt -60.79 -48.35 82.2 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.284 -0.567 . . . . 56.58 111.148 175.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.48 -43.31 96.9 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 C-N-CA 120.487 -0.485 . . . . 32.7 110.583 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 90.7 mt -53.65 -49.66 55.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.479 0 CA-C-O 121.307 0.575 . . . . 28.19 110.178 177.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -58.26 -36.31 82.36 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 120.399 -0.905 . . . . 31.95 112.902 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -71.21 -31.82 68.08 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.849 -0.74 . . . . 49.23 112.221 -177.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 20.5 m -102.61 -0.26 10.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 113.488 0.922 . . . . 35.86 113.488 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 52.3 tpt85 -61.29 -39.96 92.38 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 118.92 0.782 . . . . 34.52 112.187 -168.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -72.84 -13.26 61.25 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.866 0.691 . . . . 65.72 112.866 -175.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -80.58 -12.34 59.53 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 113.679 0.992 . . . . 57.17 113.679 177.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -124.4 147.92 47.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.69 0.677 . . . . 32.99 111.2 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -68.52 -50.46 51.92 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.363 -0.835 . . . . 47.25 111.197 175.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -100.19 140.22 34.73 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 122.001 -0.437 . . . . 32.34 110.015 -172.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 59.4 tp -53.81 -40.07 66.07 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.801 -0.636 . . . . 27.9 111.719 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 37.5 pttt -60.85 -35.5 76.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.583 -0.447 . . . . 34.08 111.235 -175.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 28.1 m -66.37 -45.5 79.92 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.109 -0.636 . . . . 18.93 110.502 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.8 85.88 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.296 -0.561 . . . . 23.17 110.943 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.63 -47.21 91.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-O 121.005 0.431 . . . . 18.31 110.837 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -70.46 -33.08 70.86 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 119.139 -1.024 . . . . 18.37 111.137 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 87.6 mtp -59.0 -44.03 91.6 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.186 -0.606 . . . . 21.92 110.296 171.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -66.55 -40.03 88.86 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.437 -0.505 . . . . 21.04 111.073 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.8 t -61.56 -44.9 99.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.122 0.487 . . . . 18.31 110.132 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.24 -47.4 83.67 Favored 'General case' 0 C--O 1.237 0.413 0 O-C-N 122.075 -0.391 . . . . 23.8 110.803 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 37.1 mt -61.88 -46.41 96.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-O 121.102 0.477 . . . . 26.45 110.387 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -60.86 -47.33 86.85 Favored 'General case' 0 C--O 1.237 0.427 0 O-C-N 122.081 -0.387 . . . . 28.05 111.413 -177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -73.73 -19.26 60.84 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 112.593 0.59 . . . . 23.25 112.593 -172.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -107.88 -1.7 20.52 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 113.155 0.798 . . . . 48.13 113.155 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -77.44 138.8 39.46 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 118.421 0.555 . . . . 56.49 110.528 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 95.7 mtt180 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.555 . . . . 76.05 110.658 175.775 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 . . . . . 0 N--CA 1.458 -0.062 0 N-CA-C 108.694 -0.854 . . . . 87.26 108.694 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 76.8 p -88.09 163.72 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.041 -0.664 . . . . 33.16 109.54 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -61.15 -39.47 90.19 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.549 -0.86 . . . . 30.22 111.26 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -64.16 -38.4 95.89 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 120.194 -1.003 . . . . 28.68 112.639 178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -67.37 -40.42 85.74 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 122.257 -0.555 . . . . 43.41 111.624 174.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 95.1 mtm-85 -66.37 -42.41 88.02 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.966 -0.694 . . . . 49.61 112.117 -177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 18.8 tt -63.05 -43.98 99.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 C-N-CA 119.265 -0.974 . . . . 23.27 111.212 -176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.64 -37.04 78.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 118.871 -1.132 . . . . 32.7 110.254 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.98 -47.82 81.53 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.961 -0.462 . . . . 53.43 110.898 175.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 67.8 mt -59.72 -45.61 94.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-O 121.017 0.437 . . . . 35.72 110.522 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 39.2 mm -71.4 -42.86 73.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 C-N-CA 120.298 -0.561 . . . . 36.81 110.608 -175.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.07 95.29 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 121.908 -0.495 . . . . 41.44 111.121 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 92.1 m -58.59 -39.36 80.16 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.711 -0.396 . . . . 47.73 111.355 176.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -66.84 -26.31 66.85 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.387 -0.525 . . . . 56.72 111.721 -178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 120.822 0.344 . . . . 63.42 110.465 178.974 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' L3D . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_