data_6kpq_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 6kpq _Structure_validation_residue.Date_analyzed 2020-06-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.371 0 CA-C-O 121.935 0.874 . . . . 94.54 110.764 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.9 mtt -109.84 142.43 41.14 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.806 -1.088 . . . . 81.26 109.259 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -129.07 158.05 40.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.491 -0.929 . . . . 73.85 108.491 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 pt -116.33 144.85 23.02 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 C-N-CA 123.98 0.912 . . . . 72.51 109.117 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.84 140.6 32.98 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.911 0.884 . . . . 76.49 109.108 175.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . 0.413 ' NH2' ' OD1' ' A' ' 58' ' ' ASP . 49.2 ttt85 -74.64 142.87 44.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.209 0.528 . . . . 67.74 111.734 -167.74 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -123.49 -15.51 7.08 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.271 1.582 . . . . 63.95 115.271 -175.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.07 174.64 39.66 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 119.733 1.151 . . . . 57.22 111.726 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' OD1' ' NH2' ' A' ' 55' ' ' ARG . 69.7 m-20 -77.92 171.99 14.16 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.179 -1.011 . . . . 65.67 110.304 165.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.7 mm -113.38 105.29 18.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.109 -1.071 . . . . 68.28 108.109 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.2 p -152.07 150.89 30.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.428 -0.953 . . . . 71.18 108.428 -172.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -82.53 130.65 35.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.413 -0.812 . . . . 70.22 111.18 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . 0.414 ' O ' ' NE2' ' B' ' 96' ' ' GLN . 1.1 mm-40 -92.24 109.15 20.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.147 0.579 . . . . 111.61 111.905 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -69.29 -16.73 63.63 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 116.235 -2.186 . . . . 84.03 112.876 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . . . -102.72 27.23 7.15 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.31 0.959 . . . . 83.84 113.057 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.87 151.39 43.42 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.82 0.819 . . . . 75.71 111.842 -171.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.53 130.26 42.34 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.093 -0.958 . . . . 96.67 108.861 166.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 60.6 t -101.83 130.25 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 107.186 -1.413 . . . . 75.9 107.186 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.4 t -167.26 165.93 15.01 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.405 -0.918 . . . . 74.01 109.497 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 128.78 5.16 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.888 -0.596 . . . . 68.61 113.734 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -76.06 -167.46 0.75 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.477 0.656 . . . . 73.24 109.806 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.3 m -135.95 75.35 54.99 Favored Pre-proline 0 CA--C 1.532 0.265 0 N-CA-C 107.676 -1.231 . . . . 67.72 107.676 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.92 153.5 19.45 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 O-C-N 122.848 0.92 . . . . 64.99 110.53 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.46 128.19 56.36 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 119.67 -0.812 . . . . 132.28 109.249 166.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -123.48 140.7 52.73 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.358 -1.349 . . . . 69.76 107.358 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -91.12 113.83 26.2 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.286 -1.005 . . . . 91.35 108.286 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.25 161.28 38.97 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 CA-C-O 121.765 0.793 . . . . 67.76 110.442 -169.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.09 137.34 53.61 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.001 1.32 . . . . 69.34 109.495 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.5 tp -109.32 102.5 11.41 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 107.853 -1.166 . . . . 71.49 107.853 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -75.48 175.3 8.62 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 122.403 1.097 . . . . 80.77 110.89 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.79 -19.37 63.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.986 -1.007 . . . . 84.15 112.749 -176.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -102.26 14.99 30.47 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.21 -0.931 . . . . 74.02 113.062 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.38 19.96 70.42 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.085 -1.055 . . . . 64.02 114.366 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -105.4 119.19 38.47 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.526 -0.916 . . . . 69.78 108.526 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -76.45 137.78 39.9 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.575 0.547 . . . . 67.22 110.25 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -128.85 159.85 34.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.053 0.941 . . . . 75.85 108.511 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -90.89 139.12 31.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 80.91 110.41 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.7 t . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 121.226 0.536 . . . . 79.63 111.381 -178.967 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.019 0 N-CA-C 111.967 0.358 . . . . 79.94 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.3 p -126.72 19.06 7.29 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 119.415 -0.326 . . . . 86.6 111.728 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.4 m -57.49 134.03 55.73 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.314 -0.625 . . . . 70.38 109.314 174.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -48.32 143.29 4.8 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.007 -0.677 . . . . 69.14 110.447 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.96 -175.38 28.24 Favored Glycine 0 C--O 1.222 -0.651 0 N-CA-C 111.259 -0.737 . . . . 52.43 111.259 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -98.19 140.63 17.69 Favored 'Isoleucine or valine' 0 C--N 1.35 0.597 0 N-CA-C 109.269 -0.641 . . . . 57.15 109.269 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -132.82 152.13 51.87 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.283 0.563 . . . . 54.53 110.932 -175.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' B' ' 104' ' ' GLU . 72.4 mtt-85 -90.57 145.29 24.99 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.474 -0.785 . . . . 60.38 109.781 171.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -107.04 110.65 32.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.727 -1.212 . . . . 60.94 107.727 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 35.6 mmm -106.66 171.16 7.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.831 0.824 . . . . 69.04 110.429 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 1.4 t -155.41 167.75 29.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.277 -1.008 . . . . 77.43 108.277 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.52 8.63 3.93 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.593 0.96 . . . . 88.74 113.593 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . . . -68.07 -2.56 8.04 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 119.054 0.843 . . . . 99.28 113.126 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 17.3 mt -128.26 -156.88 0.78 Allowed 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.236 -1.024 . . . . 96.08 108.236 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tp -76.94 100.06 5.45 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.93 -0.577 . . . . 90.8 110.185 -164.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.66 -161.68 51.51 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-O 122.549 1.083 . . . . 82.86 111.999 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.4 m -82.48 128.71 34.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.448 -0.876 . . . . 80.82 108.799 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 22.1 m -132.54 119.67 20.84 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.409 -0.589 . . . . 68.81 109.409 -171.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLN . . . . . 0.474 ' OE1' ' NH1' ' B' ' 24' ' ' ARG . 32.0 tt0 -76.06 115.45 15.78 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 109.196 -0.668 . . . . 63.14 109.196 176.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 m -97.39 -9.36 9.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 N-CA-C 112.432 0.53 . . . . 59.36 112.432 178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.38 -173.79 44.34 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.493 -1.043 . . . . 52.69 110.493 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 22.5 t -132.56 161.84 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 106.777 -1.564 . . . . 50.76 106.777 -171.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -159.42 170.24 35.67 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 118.32 -1.895 . . . . 54.85 112.681 170.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 1.4 p -119.19 142.75 32.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 122.288 1.042 . . . . 57.42 109.496 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' MET . . . . . . . . . . . . . 7.9 tpp -114.04 121.46 43.91 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.37 -1.286 . . . . 57.01 107.739 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -146.85 133.85 20.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.334 -0.987 . . . . 67.47 108.334 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 51.75 42.02 29.57 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.524 0.515 . . . . 68.0 111.581 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.32 -4.31 49.41 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 116.156 1.222 . . . . 58.01 116.156 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 59.7 t -108.56 138.7 34.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 118.636 1.218 . . . . 58.06 109.058 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -105.04 117.48 34.12 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 122.995 0.518 . . . . 54.05 109.947 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -106.37 117.06 33.06 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.69 1.196 . . . . 52.52 110.089 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 15.3 t -134.14 -165.5 1.65 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.561 -0.856 . . . . 54.36 108.819 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' MET . . . . . . . . . . . . . 32.8 mtp -104.49 143.47 32.98 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.379 -0.828 . . . . 56.37 110.631 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' TRP . . . . . . . . . . . . . 29.1 t90 -60.44 -34.33 73.83 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 114.987 -1.006 . . . . 77.93 112.201 -169.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -76.76 -13.4 60.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 117.338 -1.745 . . . . 59.43 112.046 -174.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 87.1 t -67.44 -55.74 16.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.313 0.578 . . . . 57.59 110.268 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 16.3 p -105.97 -8.08 17.79 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.307 1.225 . . . . 58.19 114.307 -173.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 2.3 mptt 47.38 31.48 1.88 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.372 0.669 . . . . 75.0 111.632 -173.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 84.28 -13.19 51.98 Favored Glycine 0 N--CA 1.441 -1.023 0 N-CA-C 115.762 1.065 . . . . 63.95 115.762 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.68 160.64 7.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 118.887 1.344 . . . . 66.88 111.063 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.07 156.35 22.24 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.876 0.846 . . . . 72.88 110.207 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 mt -122.21 163.97 18.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.953 -1.022 . . . . 71.97 109.54 -172.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -120.91 148.57 43.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.564 -0.744 . . . . 91.59 109.22 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 39.7 t -135.82 90.71 2.62 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 106.387 -1.708 . . . . 83.83 106.387 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.33 -112.94 5.01 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 110.451 -1.06 . . . . 97.68 110.451 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . . . -75.79 -37.83 58.82 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 120.011 -0.675 . . . . 95.61 111.188 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.5 -172.23 19.73 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-O 123.317 1.51 . . . . 93.31 114.019 -166.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -150.43 118.23 6.21 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.642 -1.244 . . . . 83.72 107.642 170.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mp -87.71 124.63 33.77 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.727 -0.842 . . . . 68.91 108.727 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.12 148.02 37.12 Favored Pre-proline 0 C--O 1.236 0.36 0 C-N-CA 119.898 -0.721 . . . . 84.12 110.135 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.98 146.78 72.39 Favored 'Trans proline' 0 C--O 1.237 0.439 0 N-CA-C 110.592 -0.58 . . . . 62.75 110.592 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -114.66 -50.37 2.79 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.308 -0.86 . . . . 57.27 111.909 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -136.69 150.73 48.63 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.122 0.969 . . . . 55.58 109.102 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.39 161.6 34.19 Favored Glycine 0 C--N 1.334 0.448 0 N-CA-C 111.349 -0.701 . . . . 52.73 111.349 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -158.37 108.74 2.1 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.205 -0.665 . . . . 62.73 109.205 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 2.7 t -61.3 -32.32 52.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.843 0 O-C-N 123.326 0.391 . . . . 61.48 111.823 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -68.33 -39.8 81.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.155 -1.418 . . . . 65.54 111.237 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -78.48 -16.35 57.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.799 0.666 . . . . 63.7 112.799 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t0 58.77 44.96 16.3 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.967 0.907 . . . . 56.72 111.102 -174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 mt -130.37 151.97 50.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.86 -0.609 . . . . 55.36 110.613 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.86 141.38 13.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.95 -0.759 . . . . 54.03 108.95 171.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 66.3 p -122.4 149.77 43.37 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.24 0.543 . . . . 53.86 110.364 174.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.41 139.74 51.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.569 1.148 . . . . 60.65 109.344 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 16.5 m 68.22 4.93 4.39 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.905 1.282 . . . . 65.08 113.887 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . 173.34 -179.75 44.54 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 119.882 -1.152 . . . . 48.37 112.328 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -72.32 156.57 54.7 Favored 'Trans proline' 0 C--O 1.236 0.382 0 CA-C-O 122.497 0.957 . . . . 50.9 112.622 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -53.61 127.91 27.24 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.048 -1.433 . . . . 58.45 110.397 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmtt -109.55 -7.11 15.19 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 114.468 1.284 . . . . 69.23 114.468 -174.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 43.7 mt -96.58 115.42 27.39 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.862 0.755 . . . . 59.44 109.065 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.9 p-10 -130.79 16.7 5.24 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.415 0.894 . . . . 82.14 113.415 -171.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.26 148.69 25.52 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 118.567 0.622 . . . . 62.42 109.366 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -131.78 149.93 52.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.765 -0.774 . . . . 62.98 109.844 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' TRP . . . . . 0.414 ' CE2' ' O ' ' B' ' 91' ' ' GLY . 7.4 t90 -44.35 117.58 1.29 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.763 -1.108 . . . . 71.36 110.739 163.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -56.68 -18.71 13.23 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 119.855 -0.738 . . . . 73.18 110.914 163.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' B' ' 89' ' ' TRP . . . 96.05 -64.24 1.2 Allowed Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 126.005 1.764 . . . . 95.07 109.121 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -56.4 -64.51 0.84 Allowed 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.361 1.08 . . . . 83.24 113.387 -166.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 1.9 p -61.07 163.81 5.69 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.634 -1.291 . . . . 72.27 113.879 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -75.05 172.31 12.56 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.381 1.086 . . . . 69.83 110.063 168.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.93 165.47 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.75 -1.574 . . . . 65.46 106.75 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLN . . . . . 0.414 ' NE2' ' O ' ' A' ' 62' ' ' GLU . 46.6 mt-30 -118.44 136.67 53.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.585 -0.524 . . . . 70.55 109.585 179.042 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 9.6 tp -98.79 115.3 28.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.85 -1.167 . . . . 59.45 107.85 173.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 20.2 tp -86.93 84.35 7.35 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.163 -1.421 . . . . 59.54 107.163 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.85 129.73 37.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.302 -1.317 . . . . 55.46 109.806 -174.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' VAL . . . . . . . . . . . . . 69.3 t -118.33 83.2 20.06 Favored Pre-proline 0 C--O 1.243 0.757 0 N-CA-C 106.644 -1.613 . . . . 51.8 106.644 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.39 151.81 29.79 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 C-N-CA 121.057 1.171 . . . . 59.53 109.681 -173.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -58.62 135.34 66.77 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.248 1.13 . . . . 59.13 112.16 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 73.61 -1.9 42.28 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 115.244 0.858 . . . . 58.61 115.244 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' GLU . . . . . 0.51 ' O ' ' NH2' ' B' ' 24' ' ' ARG . 93.4 mt-10 -128.76 156.43 43.55 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 122.666 1.222 . . . . 67.65 110.76 -170.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -50.57 136.65 20.85 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 116.763 2.135 . . . . 112.68 116.763 169.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.08 128.5 24.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 114.291 -1.322 . . . . 63.88 110.478 158.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -138.4 135.73 35.57 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.742 1.217 . . . . 84.45 109.288 -177.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -90.66 134.69 34.22 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.474 0.178 . . . . 67.29 110.844 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ILE . . . . . . . . . . . . . 3.9 mm -128.76 112.93 27.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.263 -1.014 . . . . 70.94 108.263 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -83.83 140.73 31.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.092 -0.503 . . . . 69.41 110.427 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.9 t -161.21 161.87 31.02 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 107.886 -1.153 . . . . 61.19 107.886 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 3.1 tp -105.97 117.92 56.41 Favored Pre-proline 0 C--O 1.244 0.775 0 N-CA-C 107.898 -1.149 . . . . 64.25 107.898 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -70.67 150.62 62.96 Favored 'Trans proline' 0 C--N 1.324 -0.763 0 CA-C-O 122.127 0.803 . . . . 63.36 112.586 -171.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -90.54 -151.4 25.92 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 114.694 -1.139 . . . . 65.35 111.469 166.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 2.7 mm -141.86 121.36 10.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 122.319 -0.518 . . . . 69.71 109.69 -167.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -82.47 114.04 20.63 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.079 -1.082 . . . . 61.05 108.079 157.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -90.42 115.11 27.34 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.007 -1.108 . . . . 98.64 108.007 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 43.4 p -111.27 -179.6 3.77 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.16 0.981 . . . . 77.71 110.317 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -75.18 -26.78 59.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.355 -0.839 . . . . 85.57 111.71 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -98.94 5.65 47.14 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.896 0.702 . . . . 84.8 112.896 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 139.55 -176.55 21.04 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.233 -0.508 . . . . 76.32 112.14 -176.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -107.76 146.94 31.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 117.565 0.682 . . . . 85.0 110.02 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 3.2 mt -121.46 146.32 26.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 107.191 -1.411 . . . . 66.28 107.191 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . -69.88 155.88 53.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.881 -1.152 . . . . 61.5 111.0 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.91 141.3 26.4 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.66 -0.816 . . . . 59.65 108.951 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 11.8 m -113.16 132.02 63.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.446 -0.946 . . . . 56.73 108.446 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.52 3.29 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 122.875 1.321 . . . . 68.44 108.876 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -137.14 122.17 19.01 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.249 -1.341 . . . . 55.37 108.435 -171.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -106.02 126.72 52.53 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.522 -0.548 . . . . 67.07 109.522 -177.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -146.0 154.29 50.59 Favored Pre-proline 0 C--O 1.22 -0.49 0 C-N-CA 124.829 1.252 . . . . 74.37 108.24 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.61 157.31 15.77 Favored 'Trans proline' 0 C--N 1.327 -0.579 0 O-C-N 123.259 1.136 . . . . 60.72 112.558 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.51 67.86 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.817 -1.083 . . . . 56.05 112.687 -170.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -76.71 11.04 15.37 Favored Glycine 0 C--O 1.239 0.408 0 C-N-CA 118.561 -1.781 . . . . 51.54 115.082 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.7 m -87.26 -3.58 59.05 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 118.058 0.929 . . . . 57.15 111.944 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -58.63 137.25 57.63 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.132 0.491 . . . . 60.54 111.008 -175.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.19 -0.63 66.54 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 119.175 -0.792 . . . . 53.48 114.46 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.9 m -66.03 137.84 96.02 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 118.538 1.169 . . . . 53.29 110.231 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.83 161.86 32.97 Favored 'Trans proline' 0 C--O 1.238 0.514 0 CA-C-O 122.511 0.963 . . . . 54.15 113.259 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 66.8 mt -126.43 126.93 69.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 113.814 -1.539 . . . . 54.84 107.135 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -112.8 149.21 33.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.586 0.708 . . . . 70.63 111.837 -167.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ASP . . . . . 0.465 ' OD2' ' NH2' ' B' ' 145' ' ' ARG . 53.7 p30 -93.2 165.61 12.73 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.114 -0.948 . . . . 67.87 109.561 166.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . . . -58.33 -13.8 6.06 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.161 0.801 . . . . 70.5 113.161 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' CYS . . . . . . . . . . . . . 1.2 m -99.14 3.82 46.67 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 119.086 0.857 . . . . 77.31 112.686 176.839 -97.834 0.0 0.0 0.0 0.0 0.0 0.0 -97.834 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 98.55 -13.82 62.44 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 116.502 1.361 . . . . 64.69 116.502 171.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ARG . . . . . 0.465 ' NH2' ' OD2' ' B' ' 141' ' ' ASP . 7.9 mtt85 -62.93 141.28 58.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.078 1.439 . . . . 86.03 111.574 177.549 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' VAL . . . . . 0.651 ' O ' ' O ' ' B' ' 301' ' ' HOH . 54.5 t -79.81 118.77 27.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 108.588 -0.893 . . . . 56.99 108.588 173.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ILE . . . . . . . . . . . . . 27.3 pt -102.62 0.57 10.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 N-CA-C 113.205 0.817 . . . . 59.11 113.205 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 165.15 176.17 36.51 Favored Glycine 0 C--O 1.236 0.281 0 C-N-CA 119.206 -1.473 . . . . 50.85 111.971 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 32.4 mt -124.46 133.08 53.47 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.529 -0.835 . . . . 51.13 109.429 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -81.14 142.96 32.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 124.359 1.037 . . . . 52.96 109.761 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.71 -20.19 2.92 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 117.143 -2.456 . . . . 50.07 118.004 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -108.93 112.86 25.31 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.202 1.001 . . . . 58.65 108.686 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -163.72 -158.11 9.76 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.649 -0.786 . . . . 65.52 113.678 -174.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . 12.1 m -126.91 168.69 19.53 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 122.373 1.082 . . . . 71.72 110.388 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 25.2 t -111.51 135.77 49.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.806 -1.183 . . . . 75.71 107.806 170.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' ILE . . . . . . . . . . . . . 3.8 pt -101.17 -179.79 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 116.151 -0.477 . . . . 93.24 109.822 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' LYS . . . . . . . . . . . . . . . -54.52 -46.13 73.48 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.674 -0.411 . . . . 81.24 111.234 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -61.73 -20.45 63.53 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.953 0.723 . . . . 96.48 112.953 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 105.25 -22.02 33.96 Favored Glycine 0 C--O 1.243 0.674 0 CA-C-O 119.401 -0.666 . . . . 83.24 114.3 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.89 -168.94 2.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 117.92 0.86 . . . . 77.63 109.421 -179.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -109.33 146.8 33.75 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.714 0.806 . . . . 70.36 111.628 -156.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' VAL . . . . . . . . . . . . . 4.6 t -133.03 121.55 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.368 -0.975 . . . . 65.26 108.368 166.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 15.3 t -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.135 0.493 . . . . 60.54 109.947 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -73.81 153.15 40.06 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.058 -0.974 . . . . 58.89 109.686 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ILE . . . . . . . . . . . . . 6.1 mt -89.63 91.76 3.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 105.086 -2.19 . . . . 55.36 105.086 166.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 89.3 m -87.33 116.8 25.67 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.892 0.877 . . . . 58.79 109.944 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -120.69 151.72 39.15 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.537 0.735 . . . . 63.56 110.508 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . -88.26 -178.64 47.08 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-O 122.562 1.09 . . . . 58.2 112.673 173.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 114.739 -0.73 . . . . 76.84 111.252 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' DT0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.651 ' O ' ' O ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.371 0 CA-C-O 121.935 0.874 . . . . 94.54 110.764 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MET . . . . . 0.43 ' HG2' ' HB ' ' B' ' 27' ' ' THR . 67.9 mtt -109.84 142.43 41.14 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.806 -1.088 . . . . 81.26 109.259 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -129.07 158.05 40.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.491 -0.929 . . . . 73.85 108.491 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 pt -116.33 144.85 23.02 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 C-N-CA 123.98 0.912 . . . . 72.51 109.117 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.84 140.6 32.98 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.911 0.884 . . . . 76.49 109.108 175.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' NH2' ' OD1' ' A' ' 58' ' ' ASP . 49.2 ttt85 -74.64 142.87 44.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.209 0.528 . . . . 67.74 111.734 -167.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -123.49 -15.51 7.08 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.271 1.582 . . . . 63.95 115.271 -175.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.07 174.64 39.66 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 119.733 1.151 . . . . 57.22 111.726 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . 0.411 ' OD1' ' NH2' ' A' ' 55' ' ' ARG . 69.7 m-20 -77.92 171.99 14.16 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.179 -1.011 . . . . 65.67 110.304 165.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.667 HD11 ' HB ' ' B' ' 22' ' ' VAL . 9.7 mm -113.38 105.29 18.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.109 -1.071 . . . . 68.28 108.109 176.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.2 p -152.07 150.89 30.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.428 -0.953 . . . . 71.18 108.428 -172.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -82.53 130.65 35.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.413 -0.812 . . . . 70.22 111.18 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HG2' ' CG ' ' B' ' 108' ' ' ASN . 1.1 mm-40 -92.24 109.15 20.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.147 0.579 . . . . 111.61 111.905 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -69.29 -16.73 63.63 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 116.235 -2.186 . . . . 84.03 112.876 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . . . -102.72 27.23 7.15 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.31 0.959 . . . . 83.84 113.057 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.87 151.39 43.42 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.82 0.819 . . . . 75.71 111.842 -171.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.53 130.26 42.34 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.093 -0.958 . . . . 96.67 108.861 166.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' B' ' 110' ' ' GLN . 60.6 t -101.83 130.25 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 107.186 -1.413 . . . . 75.9 107.186 -179.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.4 t -167.26 165.93 15.01 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.405 -0.918 . . . . 74.01 109.497 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 128.78 5.16 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.888 -0.596 . . . . 68.61 113.734 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -76.06 -167.46 0.75 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.477 0.656 . . . . 73.24 109.806 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . 0.49 ' OG ' HD23 ' B' ' 112' ' ' LEU . 1.3 m -135.95 75.35 54.99 Favored Pre-proline 0 CA--C 1.532 0.265 0 N-CA-C 107.676 -1.231 . . . . 67.72 107.676 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.92 153.5 19.45 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 O-C-N 122.848 0.92 . . . . 64.99 110.53 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.46 128.19 56.36 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 119.67 -0.812 . . . . 132.28 109.249 166.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -123.48 140.7 52.73 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.358 -1.349 . . . . 69.76 107.358 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -91.12 113.83 26.2 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.286 -1.005 . . . . 91.35 108.286 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.25 161.28 38.97 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 CA-C-O 121.765 0.793 . . . . 67.76 110.442 -169.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.09 137.34 53.61 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.001 1.32 . . . . 69.34 109.495 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.5 tp -109.32 102.5 11.41 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 107.853 -1.166 . . . . 71.49 107.853 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -75.48 175.3 8.62 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 122.403 1.097 . . . . 80.77 110.89 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.79 -19.37 63.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.986 -1.007 . . . . 84.15 112.749 -176.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -102.26 14.99 30.47 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.21 -0.931 . . . . 74.02 113.062 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.38 19.96 70.42 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.085 -1.055 . . . . 64.02 114.366 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -105.4 119.19 38.47 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.526 -0.916 . . . . 69.78 108.526 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -76.45 137.78 39.9 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.575 0.547 . . . . 67.22 110.25 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -128.85 159.85 34.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.053 0.941 . . . . 75.85 108.511 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -90.89 139.12 31.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 80.91 110.41 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.7 t . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 121.226 0.536 . . . . 79.63 111.381 -178.967 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.019 0 N-CA-C 111.967 0.358 . . . . 79.94 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.3 p -126.72 19.06 7.29 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 119.415 -0.326 . . . . 86.6 111.728 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.4 m -57.49 134.03 55.73 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.314 -0.625 . . . . 70.38 109.314 174.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -48.32 143.29 4.8 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.007 -0.677 . . . . 69.14 110.447 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.96 -175.38 28.24 Favored Glycine 0 C--O 1.222 -0.651 0 N-CA-C 111.259 -0.737 . . . . 52.43 111.259 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . 0.667 ' HB ' HD11 ' A' ' 59' ' ' ILE . 7.4 p -98.19 140.63 17.69 Favored 'Isoleucine or valine' 0 C--N 1.35 0.597 0 N-CA-C 109.269 -0.641 . . . . 57.15 109.269 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -132.82 152.13 51.87 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.283 0.563 . . . . 54.53 110.932 -175.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . 0.429 ' NH1' ' OE1' ' B' ' 35' ' ' GLN . 72.4 mtt-85 -90.57 145.29 24.99 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.474 -0.785 . . . . 60.38 109.781 171.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -107.04 110.65 32.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.727 -1.212 . . . . 60.94 107.727 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 35.6 mmm -106.66 171.16 7.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.831 0.824 . . . . 69.04 110.429 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 51' ' ' MET . 1.4 t -155.41 167.75 29.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.277 -1.008 . . . . 77.43 108.277 175.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.52 8.63 3.93 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.593 0.96 . . . . 88.74 113.593 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . . . -68.07 -2.56 8.04 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 119.054 0.843 . . . . 99.28 113.126 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 17.3 mt -128.26 -156.88 0.78 Allowed 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.236 -1.024 . . . . 96.08 108.236 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tp -76.94 100.06 5.45 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.93 -0.577 . . . . 90.8 110.185 -164.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.66 -161.68 51.51 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-O 122.549 1.083 . . . . 82.86 111.999 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.4 m -82.48 128.71 34.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.448 -0.876 . . . . 80.82 108.799 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 22.1 m -132.54 119.67 20.84 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.409 -0.589 . . . . 68.81 109.409 -171.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLN . . . . . 0.528 ' HB3' ' HB3' ' B' ' 102' ' ' PRO . 32.0 tt0 -76.06 115.45 15.78 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 109.196 -0.668 . . . . 63.14 109.196 176.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 m -97.39 -9.36 9.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 N-CA-C 112.432 0.53 . . . . 59.36 112.432 178.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.38 -173.79 44.34 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.493 -1.043 . . . . 52.69 110.493 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 22.5 t -132.56 161.84 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 106.777 -1.564 . . . . 50.76 106.777 -171.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -159.42 170.24 35.67 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 118.32 -1.895 . . . . 54.85 112.681 170.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 1.4 p -119.19 142.75 32.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 122.288 1.042 . . . . 57.42 109.496 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' MET . . . . . . . . . . . . . 7.9 tpp -114.04 121.46 43.91 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.37 -1.286 . . . . 57.01 107.739 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -146.85 133.85 20.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.334 -0.987 . . . . 67.47 108.334 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 51.75 42.02 29.57 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.524 0.515 . . . . 68.0 111.581 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.32 -4.31 49.41 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 116.156 1.222 . . . . 58.01 116.156 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 59.7 t -108.56 138.7 34.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 118.636 1.218 . . . . 58.06 109.058 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -105.04 117.48 34.12 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 122.995 0.518 . . . . 54.05 109.947 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -106.37 117.06 33.06 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.69 1.196 . . . . 52.52 110.089 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 15.3 t -134.14 -165.5 1.65 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.561 -0.856 . . . . 54.36 108.819 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' MET . . . . . . . . . . . . . 32.8 mtp -104.49 143.47 32.98 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.379 -0.828 . . . . 56.37 110.631 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' TRP . . . . . . . . . . . . . 29.1 t90 -60.44 -34.33 73.83 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 114.987 -1.006 . . . . 77.93 112.201 -169.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -76.76 -13.4 60.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 117.338 -1.745 . . . . 59.43 112.046 -174.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 87.1 t -67.44 -55.74 16.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.313 0.578 . . . . 57.59 110.268 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 16.3 p -105.97 -8.08 17.79 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.307 1.225 . . . . 58.19 114.307 -173.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 2.3 mptt 47.38 31.48 1.88 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.372 0.669 . . . . 75.0 111.632 -173.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 84.28 -13.19 51.98 Favored Glycine 0 N--CA 1.441 -1.023 0 N-CA-C 115.762 1.065 . . . . 63.95 115.762 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.68 160.64 7.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 118.887 1.344 . . . . 66.88 111.063 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.07 156.35 22.24 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.876 0.846 . . . . 72.88 110.207 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 mt -122.21 163.97 18.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.953 -1.022 . . . . 71.97 109.54 -172.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -120.91 148.57 43.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.564 -0.744 . . . . 91.59 109.22 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 39.7 t -135.82 90.71 2.62 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 106.387 -1.708 . . . . 83.83 106.387 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.33 -112.94 5.01 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 110.451 -1.06 . . . . 97.68 110.451 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . . . -75.79 -37.83 58.82 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 120.011 -0.675 . . . . 95.61 111.188 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.5 -172.23 19.73 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-O 123.317 1.51 . . . . 93.31 114.019 -166.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -150.43 118.23 6.21 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.642 -1.244 . . . . 83.72 107.642 170.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mp -87.71 124.63 33.77 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.727 -0.842 . . . . 68.91 108.727 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.12 148.02 37.12 Favored Pre-proline 0 C--O 1.236 0.36 0 C-N-CA 119.898 -0.721 . . . . 84.12 110.135 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.98 146.78 72.39 Favored 'Trans proline' 0 C--O 1.237 0.439 0 N-CA-C 110.592 -0.58 . . . . 62.75 110.592 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -114.66 -50.37 2.79 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.308 -0.86 . . . . 57.27 111.909 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -136.69 150.73 48.63 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.122 0.969 . . . . 55.58 109.102 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.39 161.6 34.19 Favored Glycine 0 C--N 1.334 0.448 0 N-CA-C 111.349 -0.701 . . . . 52.73 111.349 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -158.37 108.74 2.1 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.205 -0.665 . . . . 62.73 109.205 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 2.7 t -61.3 -32.32 52.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.843 0 O-C-N 123.326 0.391 . . . . 61.48 111.823 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -68.33 -39.8 81.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.155 -1.418 . . . . 65.54 111.237 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -78.48 -16.35 57.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.799 0.666 . . . . 63.7 112.799 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t0 58.77 44.96 16.3 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.967 0.907 . . . . 56.72 111.102 -174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 mt -130.37 151.97 50.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.86 -0.609 . . . . 55.36 110.613 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.86 141.38 13.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.95 -0.759 . . . . 54.03 108.95 171.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 66.3 p -122.4 149.77 43.37 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.24 0.543 . . . . 53.86 110.364 174.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.41 139.74 51.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.569 1.148 . . . . 60.65 109.344 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 16.5 m 68.22 4.93 4.39 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.905 1.282 . . . . 65.08 113.887 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . 173.34 -179.75 44.54 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 119.882 -1.152 . . . . 48.37 112.328 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -72.32 156.57 54.7 Favored 'Trans proline' 0 C--O 1.236 0.382 0 CA-C-O 122.497 0.957 . . . . 50.9 112.622 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -53.61 127.91 27.24 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.048 -1.433 . . . . 58.45 110.397 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmtt -109.55 -7.11 15.19 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 114.468 1.284 . . . . 69.23 114.468 -174.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 43.7 mt -96.58 115.42 27.39 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.862 0.755 . . . . 59.44 109.065 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.9 p-10 -130.79 16.7 5.24 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.415 0.894 . . . . 82.14 113.415 -171.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.26 148.69 25.52 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 118.567 0.622 . . . . 62.42 109.366 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -131.78 149.93 52.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.765 -0.774 . . . . 62.98 109.844 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' TRP . . . . . 0.473 ' CH2' ' HB2' ' B' ' 113' ' ' PRO . 7.4 t90 -44.35 117.58 1.29 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.763 -1.108 . . . . 71.36 110.739 163.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -56.68 -18.71 13.23 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 119.855 -0.738 . . . . 73.18 110.914 163.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' B' ' 89' ' ' TRP . . . 96.05 -64.24 1.2 Allowed Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 126.005 1.764 . . . . 95.07 109.121 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -56.4 -64.51 0.84 Allowed 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.361 1.08 . . . . 83.24 113.387 -166.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 1.9 p -61.07 163.81 5.69 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.634 -1.291 . . . . 72.27 113.879 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' B' ' 112' ' ' LEU . 55.8 mt-10 -75.05 172.31 12.56 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.381 1.086 . . . . 69.83 110.063 168.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.93 165.47 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.75 -1.574 . . . . 65.46 106.75 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -118.44 136.67 53.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.585 -0.524 . . . . 70.55 109.585 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 9.6 tp -98.79 115.3 28.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.85 -1.167 . . . . 59.45 107.85 173.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 20.2 tp -86.93 84.35 7.35 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.163 -1.421 . . . . 59.54 107.163 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.85 129.73 37.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.302 -1.317 . . . . 55.46 109.806 -174.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' VAL . . . . . . . . . . . . . 69.3 t -118.33 83.2 20.06 Favored Pre-proline 0 C--O 1.243 0.757 0 N-CA-C 106.644 -1.613 . . . . 51.8 106.644 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.39 151.81 29.79 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 C-N-CA 121.057 1.171 . . . . 59.53 109.681 -173.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PRO . . . . . 0.528 ' HB3' ' HB3' ' B' ' 35' ' ' GLN . 4.7 Cg_exo -58.62 135.34 66.77 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.248 1.13 . . . . 59.13 112.16 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 73.61 -1.9 42.28 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 115.244 0.858 . . . . 58.61 115.244 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -128.76 156.43 43.55 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 122.666 1.222 . . . . 67.65 110.76 -170.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -50.57 136.65 20.85 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 116.763 2.135 . . . . 112.68 116.763 169.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.08 128.5 24.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 114.291 -1.322 . . . . 63.88 110.478 158.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -138.4 135.73 35.57 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.742 1.217 . . . . 84.45 109.288 -177.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASN . . . . . 0.41 ' CG ' ' HG2' ' A' ' 62' ' ' GLU . 5.6 m120 -90.66 134.69 34.22 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.474 0.178 . . . . 67.29 110.844 179.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ILE . . . . . . . . . . . . . 3.9 mm -128.76 112.93 27.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.263 -1.014 . . . . 70.94 108.263 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLN . . . . . 0.49 ' HB3' HG22 ' A' ' 67' ' ' VAL . 12.7 tt0 -83.83 140.73 31.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.092 -0.503 . . . . 69.41 110.427 178.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.9 t -161.21 161.87 31.02 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 107.886 -1.153 . . . . 61.19 107.886 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . 0.49 HD23 ' OG ' ' A' ' 71' ' ' SER . 3.1 tp -105.97 117.92 56.41 Favored Pre-proline 0 C--O 1.244 0.775 0 N-CA-C 107.898 -1.149 . . . . 64.25 107.898 173.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' PRO . . . . . 0.473 ' HB2' ' CH2' ' B' ' 89' ' ' TRP . 27.5 Cg_exo -70.67 150.62 62.96 Favored 'Trans proline' 0 C--N 1.324 -0.763 0 CA-C-O 122.127 0.803 . . . . 63.36 112.586 -171.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -90.54 -151.4 25.92 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 114.694 -1.139 . . . . 65.35 111.469 166.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 2.7 mm -141.86 121.36 10.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 122.319 -0.518 . . . . 69.71 109.69 -167.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -82.47 114.04 20.63 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.079 -1.082 . . . . 61.05 108.079 157.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -90.42 115.11 27.34 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.007 -1.108 . . . . 98.64 108.007 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 43.4 p -111.27 -179.6 3.77 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.16 0.981 . . . . 77.71 110.317 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -75.18 -26.78 59.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.355 -0.839 . . . . 85.57 111.71 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -98.94 5.65 47.14 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.896 0.702 . . . . 84.8 112.896 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 139.55 -176.55 21.04 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.233 -0.508 . . . . 76.32 112.14 -176.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -107.76 146.94 31.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 117.565 0.682 . . . . 85.0 110.02 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 3.2 mt -121.46 146.32 26.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 107.191 -1.411 . . . . 66.28 107.191 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . -69.88 155.88 53.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.881 -1.152 . . . . 61.5 111.0 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.91 141.3 26.4 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.66 -0.816 . . . . 59.65 108.951 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 11.8 m -113.16 132.02 63.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.446 -0.946 . . . . 56.73 108.446 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.52 3.29 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 122.875 1.321 . . . . 68.44 108.876 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -137.14 122.17 19.01 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.249 -1.341 . . . . 55.37 108.435 -171.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -106.02 126.72 52.53 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.522 -0.548 . . . . 67.07 109.522 -177.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -146.0 154.29 50.59 Favored Pre-proline 0 C--O 1.22 -0.49 0 C-N-CA 124.829 1.252 . . . . 74.37 108.24 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.61 157.31 15.77 Favored 'Trans proline' 0 C--N 1.327 -0.579 0 O-C-N 123.259 1.136 . . . . 60.72 112.558 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.51 67.86 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.817 -1.083 . . . . 56.05 112.687 -170.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -76.71 11.04 15.37 Favored Glycine 0 C--O 1.239 0.408 0 C-N-CA 118.561 -1.781 . . . . 51.54 115.082 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.7 m -87.26 -3.58 59.05 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 118.058 0.929 . . . . 57.15 111.944 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -58.63 137.25 57.63 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.132 0.491 . . . . 60.54 111.008 -175.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.19 -0.63 66.54 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 119.175 -0.792 . . . . 53.48 114.46 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.9 m -66.03 137.84 96.02 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 118.538 1.169 . . . . 53.29 110.231 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.83 161.86 32.97 Favored 'Trans proline' 0 C--O 1.238 0.514 0 CA-C-O 122.511 0.963 . . . . 54.15 113.259 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 66.8 mt -126.43 126.93 69.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 113.814 -1.539 . . . . 54.84 107.135 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' LEU . . . . . 0.483 HD11 ' CG2' ' A' ' 59' ' ' ILE . 2.0 mm? -112.8 149.21 33.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.586 0.708 . . . . 70.63 111.837 -167.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ASP . . . . . 0.465 ' OD2' ' NH2' ' B' ' 145' ' ' ARG . 53.7 p30 -93.2 165.61 12.73 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.114 -0.948 . . . . 67.87 109.561 166.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . . . -58.33 -13.8 6.06 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.161 0.801 . . . . 70.5 113.161 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' CYS . . . . . . . . . . . . . 1.2 m -99.14 3.82 46.67 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 119.086 0.857 . . . . 77.31 112.686 176.839 -97.834 0.0 0.0 0.0 0.0 0.0 0.0 -97.834 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 98.55 -13.82 62.44 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 116.502 1.361 . . . . 64.69 116.502 171.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ARG . . . . . 0.465 ' NH2' ' OD2' ' B' ' 141' ' ' ASP . 7.9 mtt85 -62.93 141.28 58.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.078 1.439 . . . . 86.03 111.574 177.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' VAL . . . . . 0.651 ' O ' ' O ' ' B' ' 301' ' ' HOH . 54.5 t -79.81 118.77 27.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 108.588 -0.893 . . . . 56.99 108.588 173.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ILE . . . . . . . . . . . . . 27.3 pt -102.62 0.57 10.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 N-CA-C 113.205 0.817 . . . . 59.11 113.205 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 165.15 176.17 36.51 Favored Glycine 0 C--O 1.236 0.281 0 C-N-CA 119.206 -1.473 . . . . 50.85 111.971 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 32.4 mt -124.46 133.08 53.47 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.529 -0.835 . . . . 51.13 109.429 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -81.14 142.96 32.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 124.359 1.037 . . . . 52.96 109.761 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.71 -20.19 2.92 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 117.143 -2.456 . . . . 50.07 118.004 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -108.93 112.86 25.31 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.202 1.001 . . . . 58.65 108.686 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -163.72 -158.11 9.76 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.649 -0.786 . . . . 65.52 113.678 -174.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . 12.1 m -126.91 168.69 19.53 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 122.373 1.082 . . . . 71.72 110.388 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 25.2 t -111.51 135.77 49.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.806 -1.183 . . . . 75.71 107.806 170.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' ILE . . . . . . . . . . . . . 3.8 pt -101.17 -179.79 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 116.151 -0.477 . . . . 93.24 109.822 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' LYS . . . . . . . . . . . . . . . -54.52 -46.13 73.48 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.674 -0.411 . . . . 81.24 111.234 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -61.73 -20.45 63.53 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.953 0.723 . . . . 96.48 112.953 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 105.25 -22.02 33.96 Favored Glycine 0 C--O 1.243 0.674 0 CA-C-O 119.401 -0.666 . . . . 83.24 114.3 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.89 -168.94 2.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 117.92 0.86 . . . . 77.63 109.421 -179.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -109.33 146.8 33.75 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.714 0.806 . . . . 70.36 111.628 -156.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' VAL . . . . . . . . . . . . . 4.6 t -133.03 121.55 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.368 -0.975 . . . . 65.26 108.368 166.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 15.3 t -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.135 0.493 . . . . 60.54 109.947 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -73.81 153.15 40.06 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.058 -0.974 . . . . 58.89 109.686 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ILE . . . . . . . . . . . . . 6.1 mt -89.63 91.76 3.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 105.086 -2.19 . . . . 55.36 105.086 166.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 89.3 m -87.33 116.8 25.67 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.892 0.877 . . . . 58.79 109.944 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -120.69 151.72 39.15 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.537 0.735 . . . . 63.56 110.508 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . -88.26 -178.64 47.08 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-O 122.562 1.09 . . . . 58.2 112.673 173.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 114.739 -0.73 . . . . 76.84 111.252 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' DT0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.651 ' O ' ' O ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.236 0.371 0 CA-C-O 121.935 0.874 . . . . 94.54 110.764 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MET . . . . . 0.43 ' HG2' ' HB ' ' B' ' 27' ' ' THR . 67.9 mtt -109.84 142.43 41.14 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.806 -1.088 . . . . 81.26 109.259 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -129.07 158.05 40.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.491 -0.929 . . . . 73.85 108.491 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 11.1 pt -116.33 144.85 23.02 Favored 'Isoleucine or valine' 0 C--N 1.347 0.481 0 C-N-CA 123.98 0.912 . . . . 72.51 109.117 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -141.84 140.6 32.98 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 123.911 0.884 . . . . 76.49 109.108 175.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.411 ' NH2' ' OD1' ' A' ' 58' ' ' ASP . 49.2 ttt85 -74.64 142.87 44.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.209 0.528 . . . . 67.74 111.734 -167.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -123.49 -15.51 7.08 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.271 1.582 . . . . 63.95 115.271 -175.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.07 174.64 39.66 Favored Glycine 0 N--CA 1.446 -0.643 0 CA-C-N 119.733 1.151 . . . . 57.22 111.726 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.411 ' OD1' ' NH2' ' A' ' 55' ' ' ARG . 69.7 m-20 -77.92 171.99 14.16 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 114.179 -1.011 . . . . 65.67 110.304 165.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.667 HD11 ' HB ' ' B' ' 22' ' ' VAL . 9.7 mm -113.38 105.29 18.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.564 0 N-CA-C 108.109 -1.071 . . . . 68.28 108.109 176.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.2 p -152.07 150.89 30.43 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.428 -0.953 . . . . 71.18 108.428 -172.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 20.7 t-105 -82.53 130.65 35.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.413 -0.812 . . . . 70.22 111.18 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HG2' ' CG ' ' B' ' 108' ' ' ASN . 1.1 mm-40 -92.24 109.15 20.52 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.147 0.579 . . . . 111.61 111.905 -178.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.8 tmtt? -69.29 -16.73 63.63 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 116.235 -2.186 . . . . 84.03 112.876 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . . . -102.72 27.23 7.15 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.31 0.959 . . . . 83.84 113.057 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.87 151.39 43.42 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.82 0.819 . . . . 75.71 111.842 -171.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.53 130.26 42.34 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.093 -0.958 . . . . 96.67 108.861 166.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' B' ' 110' ' ' GLN . 60.6 t -101.83 130.25 51.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 107.186 -1.413 . . . . 75.9 107.186 -179.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 12.4 t -167.26 165.93 15.01 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 119.405 -0.918 . . . . 74.01 109.497 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.83 128.78 5.16 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.888 -0.596 . . . . 68.61 113.734 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.5 p-10 -76.06 -167.46 0.75 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.477 0.656 . . . . 73.24 109.806 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . 0.49 ' OG ' HD23 ' B' ' 112' ' ' LEU . 1.3 m -135.95 75.35 54.99 Favored Pre-proline 0 CA--C 1.532 0.265 0 N-CA-C 107.676 -1.231 . . . . 67.72 107.676 -179.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.92 153.5 19.45 Favored 'Trans proline' 0 CA--C 1.511 -0.65 0 O-C-N 122.848 0.92 . . . . 64.99 110.53 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -113.46 128.19 56.36 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 119.67 -0.812 . . . . 132.28 109.249 166.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 6.6 mt -123.48 140.7 52.73 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.358 -1.349 . . . . 69.76 107.358 -173.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -91.12 113.83 26.2 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 108.286 -1.005 . . . . 91.35 108.286 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.3 m -129.25 161.28 38.97 Favored 'Isoleucine or valine' 0 C--N 1.343 0.291 0 CA-C-O 121.765 0.793 . . . . 67.76 110.442 -169.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -126.09 137.34 53.61 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.001 1.32 . . . . 69.34 109.495 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 54.5 tp -109.32 102.5 11.41 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 107.853 -1.166 . . . . 71.49 107.853 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.1 p-10 -75.48 175.3 8.62 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 122.403 1.097 . . . . 80.77 110.89 -176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.79 -19.37 63.96 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 114.986 -1.007 . . . . 84.15 112.749 -176.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 p -102.26 14.99 30.47 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.21 -0.931 . . . . 74.02 113.062 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.38 19.96 70.42 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.085 -1.055 . . . . 64.02 114.366 173.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -105.4 119.19 38.47 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.526 -0.916 . . . . 69.78 108.526 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -76.45 137.78 39.9 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 123.575 0.547 . . . . 67.22 110.25 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.5 m -128.85 159.85 34.48 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.053 0.941 . . . . 75.85 108.511 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 mt -90.89 139.12 31.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.019 -0.537 . . . . 80.91 110.41 -177.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.7 t . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 121.226 0.536 . . . . 79.63 111.381 -178.967 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.019 0 N-CA-C 111.967 0.358 . . . . 79.94 111.967 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.3 p -126.72 19.06 7.29 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 119.415 -0.326 . . . . 86.6 111.728 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.4 m -57.49 134.03 55.73 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.314 -0.625 . . . . 70.38 109.314 174.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -48.32 143.29 4.8 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 120.007 -0.677 . . . . 69.14 110.447 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.96 -175.38 28.24 Favored Glycine 0 C--O 1.222 -0.651 0 N-CA-C 111.259 -0.737 . . . . 52.43 111.259 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.667 ' HB ' HD11 ' A' ' 59' ' ' ILE . 7.4 p -98.19 140.63 17.69 Favored 'Isoleucine or valine' 0 C--N 1.35 0.597 0 N-CA-C 109.269 -0.641 . . . . 57.15 109.269 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -132.82 152.13 51.87 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.283 0.563 . . . . 54.53 110.932 -175.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.429 ' NH1' ' OE1' ' B' ' 35' ' ' GLN . 72.4 mtt-85 -90.57 145.29 24.99 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.474 -0.785 . . . . 60.38 109.781 171.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -107.04 110.65 32.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.727 -1.212 . . . . 60.94 107.727 173.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' MET . . . . . . . . . . . . . 35.6 mmm -106.66 171.16 7.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.831 0.824 . . . . 69.04 110.429 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 51' ' ' MET . 1.4 t -155.41 167.75 29.35 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.277 -1.008 . . . . 77.43 108.277 175.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.1 mtt180 -133.52 8.63 3.93 Favored 'General case' 0 C--O 1.238 0.465 0 N-CA-C 113.593 0.96 . . . . 88.74 113.593 176.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . . . -68.07 -2.56 8.04 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 119.054 0.843 . . . . 99.28 113.126 177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 17.3 mt -128.26 -156.88 0.78 Allowed 'General case' 0 C--O 1.238 0.461 0 N-CA-C 108.236 -1.024 . . . . 96.08 108.236 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 6.6 tp -76.94 100.06 5.45 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.93 -0.577 . . . . 90.8 110.185 -164.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.66 -161.68 51.51 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-O 122.549 1.083 . . . . 82.86 111.999 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.4 m -82.48 128.71 34.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.448 -0.876 . . . . 80.82 108.799 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 22.1 m -132.54 119.67 20.84 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 109.409 -0.589 . . . . 68.81 109.409 -171.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.528 ' HB3' ' HB3' ' B' ' 102' ' ' PRO . 32.0 tt0 -76.06 115.45 15.78 Favored 'General case' 0 C--O 1.239 0.502 0 N-CA-C 109.196 -0.668 . . . . 63.14 109.196 176.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 m -97.39 -9.36 9.04 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 N-CA-C 112.432 0.53 . . . . 59.36 112.432 178.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.38 -173.79 44.34 Favored Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 110.493 -1.043 . . . . 52.69 110.493 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 22.5 t -132.56 161.84 40.84 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 106.777 -1.564 . . . . 50.76 106.777 -171.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -159.42 170.24 35.67 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 118.32 -1.895 . . . . 54.85 112.681 170.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 1.4 p -119.19 142.75 32.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 122.288 1.042 . . . . 57.42 109.496 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' MET . . . . . . . . . . . . . 7.9 tpp -114.04 121.46 43.91 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.37 -1.286 . . . . 57.01 107.739 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -146.85 133.85 20.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.334 -0.987 . . . . 67.47 108.334 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 51.75 42.02 29.57 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.524 0.515 . . . . 68.0 111.581 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 76.32 -4.31 49.41 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 116.156 1.222 . . . . 58.01 116.156 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 59.7 t -108.56 138.7 34.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 CA-C-N 118.636 1.218 . . . . 58.06 109.058 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -105.04 117.48 34.12 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 122.995 0.518 . . . . 54.05 109.947 178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -106.37 117.06 33.06 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.69 1.196 . . . . 52.52 110.089 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 15.3 t -134.14 -165.5 1.65 Allowed 'General case' 0 C--O 1.24 0.594 0 C-N-CA 119.561 -0.856 . . . . 54.36 108.819 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' MET . . . . . . . . . . . . . 32.8 mtp -104.49 143.47 32.98 Favored 'General case' 0 C--O 1.24 0.592 0 CA-C-N 115.379 -0.828 . . . . 56.37 110.631 -178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' TRP . . . . . . . . . . . . . 29.1 t90 -60.44 -34.33 73.83 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 114.987 -1.006 . . . . 77.93 112.201 -169.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -76.76 -13.4 60.03 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 117.338 -1.745 . . . . 59.43 112.046 -174.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 87.1 t -67.44 -55.74 16.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-O 121.313 0.578 . . . . 57.59 110.268 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 16.3 p -105.97 -8.08 17.79 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.307 1.225 . . . . 58.19 114.307 -173.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 2.3 mptt 47.38 31.48 1.88 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.372 0.669 . . . . 75.0 111.632 -173.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 84.28 -13.19 51.98 Favored Glycine 0 N--CA 1.441 -1.023 0 N-CA-C 115.762 1.065 . . . . 63.95 115.762 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.68 160.64 7.06 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 118.887 1.344 . . . . 66.88 111.063 -174.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.07 156.35 22.24 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.876 0.846 . . . . 72.88 110.207 -178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 mt -122.21 163.97 18.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.953 -1.022 . . . . 71.97 109.54 -172.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -120.91 148.57 43.88 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.564 -0.744 . . . . 91.59 109.22 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 39.7 t -135.82 90.71 2.62 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 106.387 -1.708 . . . . 83.83 106.387 172.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.33 -112.94 5.01 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 110.451 -1.06 . . . . 97.68 110.451 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . . . -75.79 -37.83 58.82 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 120.011 -0.675 . . . . 95.61 111.188 176.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -72.5 -172.23 19.73 Favored Glycine 0 N--CA 1.446 -0.684 0 CA-C-O 123.317 1.51 . . . . 93.31 114.019 -166.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -150.43 118.23 6.21 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.642 -1.244 . . . . 83.72 107.642 170.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mp -87.71 124.63 33.77 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.727 -0.842 . . . . 68.91 108.727 177.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.12 148.02 37.12 Favored Pre-proline 0 C--O 1.236 0.36 0 C-N-CA 119.898 -0.721 . . . . 84.12 110.135 178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.98 146.78 72.39 Favored 'Trans proline' 0 C--O 1.237 0.439 0 N-CA-C 110.592 -0.58 . . . . 62.75 110.592 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -114.66 -50.37 2.79 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.308 -0.86 . . . . 57.27 111.909 -177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' TRP . . . . . . . . . . . . . 37.4 t90 -136.69 150.73 48.63 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 124.122 0.969 . . . . 55.58 109.102 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.39 161.6 34.19 Favored Glycine 0 C--N 1.334 0.448 0 N-CA-C 111.349 -0.701 . . . . 52.73 111.349 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -158.37 108.74 2.1 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.205 -0.665 . . . . 62.73 109.205 -177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 2.7 t -61.3 -32.32 52.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.843 0 O-C-N 123.326 0.391 . . . . 61.48 111.823 -177.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -68.33 -39.8 81.8 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.155 -1.418 . . . . 65.54 111.237 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -78.48 -16.35 57.62 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.799 0.666 . . . . 63.7 112.799 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t0 58.77 44.96 16.3 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 123.967 0.907 . . . . 56.72 111.102 -174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.7 mt -130.37 151.97 50.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 115.86 -0.609 . . . . 55.36 110.613 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.86 141.38 13.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.95 -0.759 . . . . 54.03 108.95 171.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 66.3 p -122.4 149.77 43.37 Favored 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.24 0.543 . . . . 53.86 110.364 174.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -119.41 139.74 51.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.569 1.148 . . . . 60.65 109.344 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 16.5 m 68.22 4.93 4.39 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 124.905 1.282 . . . . 65.08 113.887 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . 173.34 -179.75 44.54 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 119.882 -1.152 . . . . 48.37 112.328 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -72.32 156.57 54.7 Favored 'Trans proline' 0 C--O 1.236 0.382 0 CA-C-O 122.497 0.957 . . . . 50.9 112.622 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' TRP . . . . . . . . . . . . . 51.4 t-105 -53.61 127.91 27.24 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 114.048 -1.433 . . . . 58.45 110.397 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . 31.0 mmtt -109.55 -7.11 15.19 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 114.468 1.284 . . . . 69.23 114.468 -174.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 43.7 mt -96.58 115.42 27.39 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.862 0.755 . . . . 59.44 109.065 -170.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.9 p-10 -130.79 16.7 5.24 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 113.415 0.894 . . . . 82.14 113.415 -171.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.26 148.69 25.52 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 118.567 0.622 . . . . 62.42 109.366 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ALA . . . . . . . . . . . . . . . -131.78 149.93 52.31 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.765 -0.774 . . . . 62.98 109.844 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' TRP . . . . . 0.473 ' CH2' ' HB2' ' B' ' 113' ' ' PRO . 7.4 t90 -44.35 117.58 1.29 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.763 -1.108 . . . . 71.36 110.739 163.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -56.68 -18.71 13.23 Favored 'General case' 0 C--N 1.35 0.59 0 C-N-CA 119.855 -0.738 . . . . 73.18 110.914 163.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLY . . . . . 0.414 ' O ' ' CE2' ' B' ' 89' ' ' TRP . . . 96.05 -64.24 1.2 Allowed Glycine 0 N--CA 1.424 -2.162 0 C-N-CA 126.005 1.764 . . . . 95.07 109.121 -172.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -56.4 -64.51 0.84 Allowed 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.361 1.08 . . . . 83.24 113.387 -166.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 1.9 p -61.07 163.81 5.69 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.634 -1.291 . . . . 72.27 113.879 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' B' ' 112' ' ' LEU . 55.8 mt-10 -75.05 172.31 12.56 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.381 1.086 . . . . 69.83 110.063 168.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' VAL . . . . . . . . . . . . . 22.1 m -141.93 165.47 17.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.75 -1.574 . . . . 65.46 106.75 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -118.44 136.67 53.64 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.585 -0.524 . . . . 70.55 109.585 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 9.6 tp -98.79 115.3 28.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 107.85 -1.167 . . . . 59.45 107.85 173.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 20.2 tp -86.93 84.35 7.35 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.163 -1.421 . . . . 59.54 107.163 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.85 129.73 37.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.302 -1.317 . . . . 55.46 109.806 -174.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' VAL . . . . . . . . . . . . . 69.3 t -118.33 83.2 20.06 Favored Pre-proline 0 C--O 1.243 0.757 0 N-CA-C 106.644 -1.613 . . . . 51.8 106.644 175.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.39 151.81 29.79 Favored 'Trans proline' 0 CA--C 1.551 1.338 0 C-N-CA 121.057 1.171 . . . . 59.53 109.681 -173.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.528 ' HB3' ' HB3' ' B' ' 35' ' ' GLN . 4.7 Cg_exo -58.62 135.34 66.77 Favored 'Trans proline' 0 N--CA 1.487 1.115 0 O-C-N 123.248 1.13 . . . . 59.13 112.16 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLY . . . . . . . . . . . . . . . 73.61 -1.9 42.28 Favored Glycine 0 C--O 1.246 0.9 0 N-CA-C 115.244 0.858 . . . . 58.61 115.244 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -128.76 156.43 43.55 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 122.666 1.222 . . . . 67.65 110.76 -170.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -50.57 136.65 20.85 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 116.763 2.135 . . . . 112.68 116.763 169.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.08 128.5 24.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 114.291 -1.322 . . . . 63.88 110.478 158.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -138.4 135.73 35.57 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.742 1.217 . . . . 84.45 109.288 -177.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASN . . . . . 0.41 ' CG ' ' HG2' ' A' ' 62' ' ' GLU . 5.6 m120 -90.66 134.69 34.22 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.474 0.178 . . . . 67.29 110.844 179.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ILE . . . . . . . . . . . . . 3.9 mm -128.76 112.93 27.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 108.263 -1.014 . . . . 70.94 108.263 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLN . . . . . 0.49 ' HB3' HG22 ' A' ' 67' ' ' VAL . 12.7 tt0 -83.83 140.73 31.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.092 -0.503 . . . . 69.41 110.427 178.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.9 t -161.21 161.87 31.02 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 107.886 -1.153 . . . . 61.19 107.886 -179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.49 HD23 ' OG ' ' A' ' 71' ' ' SER . 3.1 tp -105.97 117.92 56.41 Favored Pre-proline 0 C--O 1.244 0.775 0 N-CA-C 107.898 -1.149 . . . . 64.25 107.898 173.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' PRO . . . . . 0.473 ' HB2' ' CH2' ' B' ' 89' ' ' TRP . 27.5 Cg_exo -70.67 150.62 62.96 Favored 'Trans proline' 0 C--N 1.324 -0.763 0 CA-C-O 122.127 0.803 . . . . 63.36 112.586 -171.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -90.54 -151.4 25.92 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 114.694 -1.139 . . . . 65.35 111.469 166.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ILE . . . . . . . . . . . . . 2.7 mm -141.86 121.36 10.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 O-C-N 122.319 -0.518 . . . . 69.71 109.69 -167.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 8.4 m-30 -82.47 114.04 20.63 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.079 -1.082 . . . . 61.05 108.079 157.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -90.42 115.11 27.34 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 108.007 -1.108 . . . . 98.64 108.007 173.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 43.4 p -111.27 -179.6 3.77 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.16 0.981 . . . . 77.71 110.317 176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -75.18 -26.78 59.3 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 115.355 -0.839 . . . . 85.57 111.71 176.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -98.94 5.65 47.14 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.896 0.702 . . . . 84.8 112.896 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 139.55 -176.55 21.04 Favored Glycine 0 C--N 1.333 0.401 0 C-N-CA 121.233 -0.508 . . . . 76.32 112.14 -176.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -107.76 146.94 31.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 117.565 0.682 . . . . 85.0 110.02 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ILE . . . . . . . . . . . . . 3.2 mt -121.46 146.32 26.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 107.191 -1.411 . . . . 66.28 107.191 176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . -69.88 155.88 53.32 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.881 -1.152 . . . . 61.5 111.0 171.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -146.91 141.3 26.4 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.66 -0.816 . . . . 59.65 108.951 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' VAL . . . . . . . . . . . . . 11.8 m -113.16 132.02 63.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 108.446 -0.946 . . . . 56.73 108.446 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . -95.45 74.52 3.29 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 122.875 1.321 . . . . 68.44 108.876 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 96.1 mt -137.14 122.17 19.01 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.249 -1.341 . . . . 55.37 108.435 -171.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 31.8 t0 -106.02 126.72 52.53 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.522 -0.548 . . . . 67.07 109.522 -177.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -146.0 154.29 50.59 Favored Pre-proline 0 C--O 1.22 -0.49 0 C-N-CA 124.829 1.252 . . . . 74.37 108.24 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.61 157.31 15.77 Favored 'Trans proline' 0 C--N 1.327 -0.579 0 O-C-N 123.259 1.136 . . . . 60.72 112.558 -175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.4 -35.51 67.86 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 114.817 -1.083 . . . . 56.05 112.687 -170.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLY . . . . . . . . . . . . . . . -76.71 11.04 15.37 Favored Glycine 0 C--O 1.239 0.408 0 C-N-CA 118.561 -1.781 . . . . 51.54 115.082 -177.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.7 m -87.26 -3.58 59.05 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 118.058 0.929 . . . . 57.15 111.944 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -58.63 137.25 57.63 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-O 121.132 0.491 . . . . 60.54 111.008 -175.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.19 -0.63 66.54 Favored Glycine 0 N--CA 1.442 -0.901 0 CA-C-O 119.175 -0.792 . . . . 53.48 114.46 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' SER . . . . . . . . . . . . . 47.9 m -66.03 137.84 96.02 Favored Pre-proline 0 C--N 1.322 -0.604 0 CA-C-N 118.538 1.169 . . . . 53.29 110.231 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.83 161.86 32.97 Favored 'Trans proline' 0 C--O 1.238 0.514 0 CA-C-O 122.511 0.963 . . . . 54.15 113.259 -175.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ILE . . . . . . . . . . . . . 66.8 mt -126.43 126.93 69.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 113.814 -1.539 . . . . 54.84 107.135 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' LEU . . . . . 0.483 HD11 ' CG2' ' A' ' 59' ' ' ILE . 2.0 mm? -112.8 149.21 33.36 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.586 0.708 . . . . 70.63 111.837 -167.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ASP . . . . . 0.465 ' OD2' ' NH2' ' B' ' 145' ' ' ARG . 53.7 p30 -93.2 165.61 12.73 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.114 -0.948 . . . . 67.87 109.561 166.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' LYS . . . . . . . . . . . . . . . -58.33 -13.8 6.06 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.161 0.801 . . . . 70.5 113.161 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' CYS . . . . . . . . . . . . . 1.2 m -99.14 3.82 46.67 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 119.086 0.857 . . . . 77.31 112.686 176.839 -97.834 0.0 0.0 0.0 0.0 0.0 0.0 -97.834 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLY . . . . . . . . . . . . . . . 98.55 -13.82 62.44 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 116.502 1.361 . . . . 64.69 116.502 171.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ARG . . . . . 0.465 ' NH2' ' OD2' ' B' ' 141' ' ' ASP . 7.9 mtt85 -62.93 141.28 58.78 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.078 1.439 . . . . 86.03 111.574 177.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' VAL . . . . . 0.651 ' O ' ' O ' ' B' ' 301' ' ' HOH . 54.5 t -79.81 118.77 27.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 108.588 -0.893 . . . . 56.99 108.588 173.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ILE . . . . . . . . . . . . . 27.3 pt -102.62 0.57 10.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.555 0 N-CA-C 113.205 0.817 . . . . 59.11 113.205 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 165.15 176.17 36.51 Favored Glycine 0 C--O 1.236 0.281 0 C-N-CA 119.206 -1.473 . . . . 50.85 111.971 -177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 32.4 mt -124.46 133.08 53.47 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 114.529 -0.835 . . . . 51.13 109.429 -174.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -81.14 142.96 32.75 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 124.359 1.037 . . . . 52.96 109.761 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 139.71 -20.19 2.92 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 117.143 -2.456 . . . . 50.07 118.004 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -108.93 112.86 25.31 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 118.202 1.001 . . . . 58.65 108.686 176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -163.72 -158.11 9.76 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.649 -0.786 . . . . 65.52 113.678 -174.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . 12.1 m -126.91 168.69 19.53 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-O 122.373 1.082 . . . . 71.72 110.388 -171.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' VAL . . . . . . . . . . . . . 25.2 t -111.51 135.77 49.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 N-CA-C 107.806 -1.183 . . . . 75.71 107.806 170.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' ILE . . . . . . . . . . . . . 3.8 pt -101.17 -179.79 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 116.151 -0.477 . . . . 93.24 109.822 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' LYS . . . . . . . . . . . . . . . -54.52 -46.13 73.48 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 120.674 -0.411 . . . . 81.24 111.234 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -61.73 -20.45 63.53 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 112.953 0.723 . . . . 96.48 112.953 -176.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 105.25 -22.02 33.96 Favored Glycine 0 C--O 1.243 0.674 0 CA-C-O 119.401 -0.666 . . . . 83.24 114.3 175.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -88.89 -168.94 2.34 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 117.92 0.86 . . . . 77.63 109.421 -179.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -109.33 146.8 33.75 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.714 0.806 . . . . 70.36 111.628 -156.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' VAL . . . . . . . . . . . . . 4.6 t -133.03 121.55 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.368 -0.975 . . . . 65.26 108.368 166.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 15.3 t -106.46 144.34 33.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.135 0.493 . . . . 60.54 109.947 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' ALA . . . . . . . . . . . . . . . -73.81 153.15 40.06 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.058 -0.974 . . . . 58.89 109.686 172.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ILE . . . . . . . . . . . . . 6.1 mt -89.63 91.76 3.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 105.086 -2.19 . . . . 55.36 105.086 166.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' THR . . . . . . . . . . . . . 89.3 m -87.33 116.8 25.67 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.892 0.877 . . . . 58.79 109.944 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -120.69 151.72 39.15 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.537 0.735 . . . . 63.56 110.508 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . -88.26 -178.64 47.08 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-O 122.562 1.09 . . . . 58.2 112.673 173.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.323 0 CA-C-N 114.739 -0.73 . . . . 76.84 111.252 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' DT0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.651 ' O ' ' O ' ' B' ' 146' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_