data_6pgv_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 6pgv _Structure_validation_residue.Date_analyzed 2019-10-18 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 ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.53 0.308 0 N-CA-C 112.451 0.135 . . . . 94.5 112.451 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.9 p -75.14 -174.68 2.38 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.808 0.813 . . . . 104.19 109.803 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.7 t -103.55 113.43 40.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.383 -0.969 . . . . 74.32 108.383 -175.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -77.45 130.67 37.33 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.28 -0.637 . . . . 65.05 109.28 173.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -147.88 100.13 3.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.636 -0.875 . . . . 65.9 108.636 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.89 135.53 38.83 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.474 0.484 . . . . 64.14 110.47 172.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.7 mtm105 -119.21 151.52 38.23 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.292 0.568 . . . . 103.64 110.733 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.66 152.16 44.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.432 -0.804 . . . . 89.03 110.602 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.4 ptt-85 -70.28 149.54 47.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.505 -0.77 . . . . 110.73 109.575 171.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.2 153.53 9.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.311 -0.859 . . . . 111.98 111.014 -176.293 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' OE2' ' OG ' ' A' ' 141' ' ' SER . 0.6 OUTLIER -84.25 -17.45 39.71 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.393 0.886 . . . . 94.81 113.393 -172.234 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt 58.16 38.24 26.35 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.598 0.636 . . . . 84.29 111.46 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 p -64.2 -32.48 74.08 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.961 -0.696 . . . . 45.94 111.781 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.37 89.62 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.235 -0.586 . . . . 46.53 111.274 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.91 -43.81 67.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 120.809 -0.356 . . . . 49.66 110.738 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -65.47 -36.69 84.63 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.927 -0.709 . . . . 60.49 111.245 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.46 -40.94 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.44 -0.504 . . . . 45.63 111.24 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.01 -48.77 80.25 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.131 -0.628 . . . . 43.2 110.827 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.56 -40.22 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.564 -0.454 . . . . 51.56 111.597 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.24 -38.59 81.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.842 -0.743 . . . . 51.09 111.49 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . 0.509 ' O ' ' NH1' ' A' ' 130' ' ' ARG . 1.2 p -69.69 -21.37 24.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.284 -0.966 . . . . 56.75 111.216 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.2 mt -99.99 -5.26 28.44 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.959 0.726 . . . . 50.79 112.959 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 58.53 44.41 17.89 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.1 0.56 . . . . 56.37 111.607 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -170.14 141.8 2.17 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.068 -0.715 . . . . 65.79 109.068 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -80.13 69.33 6.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.683 1.23 . . . . 70.96 109.151 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.46 -46.37 10.26 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.698 -1.137 . . . . 73.17 112.536 -174.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -103.1 161.0 14.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.882 0.849 . . . . 51.38 110.928 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.7 p -142.4 174.99 10.12 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 114.925 -1.034 . . . . 77.43 108.362 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -60.39 -33.46 72.5 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.689 -0.687 . . . . 78.69 110.974 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -70.36 -40.94 73.74 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.818 -0.353 . . . . 102.62 111.103 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.47 94.88 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.137 -0.625 . . . . 70.84 111.101 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.45 -46.21 87.32 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.565 -0.454 . . . . 65.91 111.008 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -62.21 -40.28 95.57 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.544 -0.462 . . . . 82.62 111.297 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -61.48 -40.88 96.14 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.559 -0.456 . . . . 113.08 111.087 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 90.3 mt -67.3 -40.25 84.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 C-N-CA 120.718 -0.393 . . . . 76.81 110.531 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 16.5 t -65.34 -20.8 66.56 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.6 0.592 . . . . 104.29 112.6 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mttm -67.6 -53.53 27.31 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.402 0.546 . . . . 110.6 111.292 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -74.56 -4.88 39.64 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.396 0.887 . . . . 104.6 113.396 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.3 mt -93.18 -10.97 33.88 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.998 0.74 . . . . 97.42 112.998 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 118.386 0.539 . . . . 108.94 111.066 179.339 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 121.775 0.798 . . . . 149.24 110.812 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 70.8 4.76 55.25 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 115.635 1.014 . . . . 117.1 115.635 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -115.88 70.22 0.75 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.483 1.141 . . . . 106.48 107.935 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -75.1 141.94 43.71 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.224 0.535 . . . . 68.44 111.121 -170.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -87.65 179.32 6.54 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.73 0.776 . . . . 59.01 110.344 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -72.62 -21.2 19.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 115.837 -0.62 . . . . 52.1 111.549 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 51.4 m-20 -63.09 -40.56 98.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.555 -0.458 . . . . 58.09 111.086 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.71 -43.34 96.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.936 0.398 . . . . 52.77 110.541 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 39.9 mt -62.11 -44.02 98.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 O-C-N 121.968 -0.458 . . . . 54.06 110.62 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MSE . . . . . . . . . . . . . 45.8 mtt -62.92 -43.57 98.44 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.692 -0.63 . . . . 54.58 111.882 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.93 85.97 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.893 -0.594 . . . . 49.08 111.514 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.71 89.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.324 -0.55 . . . . 45.37 111.019 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.2 mt -67.02 -36.44 82.13 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.571 -0.452 . . . . 46.46 111.074 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.39 -37.32 85.28 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.825 -0.35 . . . . 80.9 111.349 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.05 -18.08 56.69 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.78 -0.724 . . . . 54.48 113.769 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.3 mt -103.21 17.31 24.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 117.677 0.739 . . . . 49.28 112.28 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.11 16.7 69.07 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.346 -0.931 . . . . 51.17 114.839 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 71.6 mt -106.22 -177.61 3.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.138 0.969 . . . . 46.22 109.538 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -157.23 153.6 27.83 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.342 -0.614 . . . . 45.79 109.342 -177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.07 112.03 23.77 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.018 -1.105 . . . . 54.75 108.018 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 66.0 t -91.94 133.51 33.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.228 -1.027 . . . . 55.57 108.228 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -85.38 121.65 28.4 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.019 -0.734 . . . . 55.19 109.019 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 70.3 t-105 -77.11 128.68 34.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.554 -0.294 . . . . 64.2 110.448 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -73.13 113.18 9.89 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.883 -0.784 . . . . 67.19 108.883 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -59.96 -18.33 44.64 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.364 0.505 . . . . 123.35 112.364 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -76.1 -24.48 55.01 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.314 0.506 . . . . 84.77 111.971 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -70.65 146.33 93.51 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 120.749 -0.38 . . . . 103.36 110.917 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -65.73 142.98 72.47 Favored 'Trans proline' 0 C--N 1.333 -0.268 0 N-CA-C 110.203 -0.73 . . . . 74.87 110.203 170.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.2 mt -65.34 -18.21 65.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.771 -0.65 . . . . 80.62 112.384 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 63.6 p -65.26 -23.8 67.14 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.388 0.514 . . . . 82.62 112.388 175.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -79.88 -0.88 36.7 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.221 0.823 . . . . 89.56 113.221 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -92.33 111.67 23.33 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.881 -0.785 . . . . 71.23 108.881 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.13 80.47 9.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.416 1.103 . . . . 60.22 108.326 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.4 mt -53.58 -39.12 69.93 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.572 1.323 . . . . 57.44 114.572 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -57.79 -28.06 80.61 Favored 'Trans proline' 0 C--O 1.238 0.522 0 CA-C-N 121.57 1.596 . . . . 65.79 113.98 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -78.9 -5.89 54.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.997 0.74 . . . . 60.66 112.997 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 74.1 t -102.96 134.49 43.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.178 -0.675 . . . . 69.17 109.178 -173.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 67.5 mt -64.02 -42.15 97.22 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.268 -0.573 . . . . 66.95 110.969 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -178.23 179.72 48.45 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.389 -1.484 . . . . 45.57 109.389 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.4 mp -123.03 135.47 54.46 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.387 -0.598 . . . . 60.18 109.387 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 49.9 mt -111.63 115.35 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.002 -1.481 . . . . 42.23 107.002 170.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.95 157.38 16.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.628 0.728 . . . . 62.61 110.42 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -123.46 102.88 8.13 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.709 -1.589 . . . . 67.22 106.709 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 mt -111.22 151.74 43.33 Favored Pre-proline 0 N--CA 1.448 -0.526 0 C-N-CA 123.375 0.67 . . . . 69.49 110.682 -175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.88 147.12 38.71 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-O 121.753 0.647 . . . . 75.93 111.512 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.36 104.43 50.04 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.111 -1.035 . . . . 103.4 109.1 175.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo . . . . . 0 C--O 1.212 -0.812 0 C-N-CA 122.251 1.968 . . . . 133.32 113.773 -179.013 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.866 0.365 . . . . 151.49 111.559 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -134.0 147.71 51.02 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.466 -0.568 . . . . 127.29 109.466 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 mtt-85 -132.97 155.81 48.46 Favored 'General case' 0 C--O 1.203 -1.349 0 CA-C-N 115.528 -0.76 . . . . 102.02 111.636 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 210' ' ' HOH . 6.2 p-80 -142.98 153.5 43.08 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 120.11 -0.636 . . . . 63.1 112.604 176.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -92.19 137.47 32.34 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 121.211 0.529 . . . . 52.65 112.019 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 77.3 t -136.72 138.69 46.0 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 O-C-N 122.196 -0.315 . . . . 52.48 111.552 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.92 134.62 41.51 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.086 0.554 . . . . 47.78 110.244 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 22.5 mt -115.02 136.23 53.35 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.113 -1.069 . . . . 72.81 108.113 165.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . 0.509 ' NH1' ' O ' ' A' ' 32' ' ' VAL . 12.9 tpt180 -153.58 138.49 17.17 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.815 -0.354 . . . . 69.57 110.073 -168.501 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -90.32 136.5 33.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.62 -0.718 . . . . 109.75 110.099 174.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.3 t -134.62 116.03 20.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.84 -1.17 . . . . 79.34 107.84 173.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.1 t70 56.02 37.78 29.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.465 0.65 . . . . 89.97 111.376 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 90.44 -10.42 74.5 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 115.556 0.982 . . . . 93.72 115.556 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.78 125.54 62.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 118.653 1.227 . . . . 79.49 108.555 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -84.19 143.24 29.75 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.063 0.458 . . . . 68.95 110.466 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -128.03 144.53 51.11 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.837 -0.62 . . . . 74.84 110.113 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -86.11 106.58 17.34 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.186 -1.413 . . . . 64.92 107.186 165.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.67 31.74 2.23 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.276 0.473 . . . . 57.31 112.276 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -49.26 123.13 6.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.801 0.334 . . . . 70.16 110.387 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . 0.417 ' OG ' ' OE2' ' A' ' 22' ' ' GLU . 62.0 p -65.63 -17.1 64.34 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.533 0.568 . . . . 65.43 112.533 -177.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -79.36 -13.01 59.91 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.764 0.653 . . . . 80.74 112.764 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 88.2 mt -75.07 153.52 38.33 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.468 0.651 . . . . 81.49 110.475 176.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -81.16 -24.09 37.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.873 -0.731 . . . . 125.44 111.447 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -148.46 153.51 40.36 Favored Pre-proline 0 C--O 1.238 0.449 0 N-CA-C 107.882 -1.155 . . . . 78.71 107.882 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.21 145.01 99.12 Favored 'Trans proline' 0 C--N 1.333 -0.274 0 CA-C-O 121.783 0.66 . . . . 79.58 111.382 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.09 117.52 34.23 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.107 -0.951 . . . . 113.22 108.536 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.24 130.54 39.93 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.279 -0.419 . . . . 92.36 110.378 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 79.5 mt -103.79 -17.42 15.08 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.261 0.838 . . . . 87.86 113.261 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 102.33 -138.66 14.04 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 118.35 0.523 . . . . 79.24 113.588 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.76 -162.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.372 -0.603 . . . . 116.16 109.372 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -61.9 -38.73 89.45 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.614 -0.434 . . . . 126.39 111.413 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.37 -41.36 96.97 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 115.54 111.261 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -63.1 -48.92 75.99 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.159 -1.02 . . . . 102.17 112.658 -178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.08 -29.84 38.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 119.916 -0.714 . . . . 77.8 110.616 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 8.2 ttm-85 -64.01 -39.77 94.85 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.746 -0.597 . . . . 98.28 110.974 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -36.98 82.79 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.242 -0.583 . . . . 88.26 110.9 173.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -60.34 -48.95 79.55 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.873 0.368 . . . . 80.81 110.905 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 42.7 mt -62.2 -43.62 98.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.653 -0.419 . . . . 79.36 111.333 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.46 86.77 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.335 -0.546 . . . . 95.72 111.226 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -72.87 -31.71 64.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.049 -0.661 . . . . 98.06 111.524 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -72.26 -38.59 68.83 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.156 -0.618 . . . . 94.9 111.184 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.8 -37.91 70.32 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.514 -0.474 . . . . 98.14 111.4 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -66.67 -25.54 66.61 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.134 -0.626 . . . . 113.04 111.592 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -66.57 -24.92 66.41 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.768 -0.373 . . . . 130.71 111.98 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 93.34 156.39 32.63 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.211 0.895 . . . . 114.27 112.538 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mp 62.28 37.12 14.25 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 114.686 -0.757 . . . . 107.97 111.71 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' CYS . . . . . . . . . . . . . 44.8 t -118.51 127.9 54.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.821 -0.437 . . . . 76.08 109.821 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -117.61 131.41 56.67 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.016 -0.735 . . . . 91.31 109.016 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.2 t -111.12 118.53 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 108.486 -0.931 . . . . 57.42 108.486 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 65.3 mt -106.6 136.5 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.142 -0.688 . . . . 51.52 109.142 173.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 51.8 mt -99.09 122.23 42.05 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.61 -0.885 . . . . 57.23 108.61 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.61 113.35 25.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 107.237 -1.394 . . . . 44.93 107.237 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 18.3 m -137.29 164.62 29.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.672 0.749 . . . . 48.89 109.413 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 44.7 p -71.21 164.71 25.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.304 -0.862 . . . . 52.38 110.302 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -63.08 -34.05 76.76 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 98.43 111.174 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -65.07 -47.22 78.09 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.735 0.302 . . . . 109.91 111.15 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.86 -33.12 59.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.596 -0.442 . . . . 59.75 110.824 178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -67.16 -44.21 80.31 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.746 -0.781 . . . . 65.96 111.228 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -63.99 -40.75 97.07 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.485 -0.486 . . . . 90.74 111.495 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.93 -19.59 51.4 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.865 0.691 . . . . 86.98 112.865 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . 65.6 22.14 69.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 119.994 -1.098 . . . . 64.54 114.127 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 78.4 p -74.65 -1.2 20.67 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.91 0.855 . . . . 72.74 112.946 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -69.45 -22.42 63.65 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.633 0.651 . . . . 57.7 111.556 167.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 63.8 tp -95.25 115.31 27.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.003 -0.74 . . . . 78.82 109.003 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.347 -0.388 . . . . 123.04 111.646 -178.458 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.751 0.31 . . . . 96.45 110.336 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 64' ' ' GLU . 78.2 mt-30 -109.14 136.13 49.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.857 0.361 . . . . 101.57 110.394 -177.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 pt -129.9 157.86 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 107.688 -1.227 . . . . 82.72 107.688 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -111.84 140.5 46.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.471 -0.786 . . . . 96.4 110.124 -177.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.6 t -118.6 117.81 55.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 107.665 -1.235 . . . . 62.75 107.665 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -103.93 133.0 49.64 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.304 -0.628 . . . . 104.12 109.304 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -104.14 166.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.811 0.815 . . . . 75.27 110.517 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.94 -18.48 65.37 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.296 -0.866 . . . . 100.66 112.749 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 54.5 p -89.49 11.25 19.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.672 0.619 . . . . 96.64 112.672 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.85 0.97 89.93 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.638 1.015 . . . . 79.44 115.638 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -76.77 151.96 35.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.709 1.255 . . . . 87.44 110.523 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 16.9 m -122.96 123.3 40.62 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.624 -0.88 . . . . 79.45 108.624 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mt -103.96 132.21 50.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 108.164 -1.05 . . . . 69.45 108.164 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.9 m -102.53 133.39 47.59 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.103 -0.702 . . . . 72.96 109.103 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -130.62 146.78 52.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.09 0.471 . . . . 70.85 109.985 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -104.01 120.94 42.14 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.991 -1.114 . . . . 88.08 107.991 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -140.84 172.62 10.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 121.835 0.826 . . . . 89.07 109.431 -172.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -125.06 151.84 69.67 Favored Pre-proline 0 N--CA 1.452 -0.345 0 C-N-CA 125.039 1.336 . . . . 98.35 109.419 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.46 -31.48 78.24 Favored 'Trans proline' 0 C--O 1.237 0.468 0 N-CA-C 113.386 0.495 . . . . 99.28 113.386 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 45.9 p -77.94 -6.94 56.01 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.208 0.818 . . . . 111.79 113.208 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.0 133.53 51.9 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.667 0.667 . . . . 104.2 109.941 175.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 60.5 p -76.1 161.67 28.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.726 0.774 . . . . 91.6 110.122 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 mm -57.59 -33.17 44.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.332 -0.849 . . . . 84.39 110.291 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.94 -38.39 90.91 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 121.942 -0.474 . . . . 87.08 111.311 175.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.78 -39.24 93.78 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.197 -0.601 . . . . 92.4 110.948 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 87.7 t -62.9 -43.25 98.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.691 -0.404 . . . . 65.72 110.283 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.33 -32.6 74.32 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.249 -0.581 . . . . 61.69 111.511 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.84 -37.37 81.81 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.377 -0.529 . . . . 61.36 111.228 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -69.65 -32.0 70.41 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.277 -0.569 . . . . 67.26 111.424 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -67.1 -35.6 74.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.499 -0.48 . . . . 53.15 110.329 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -66.12 -38.37 88.02 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 121.902 -0.499 . . . . 73.58 111.391 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.77 -38.98 90.06 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.306 -0.558 . . . . 69.18 111.379 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -86.41 -42.23 13.8 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.009 0.744 . . . . 64.1 113.009 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -104.78 -15.84 15.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.804 1.038 . . . . 75.73 113.804 -171.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 -1.65 84.85 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 119.132 -0.816 . . . . 66.59 114.931 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mt -74.08 121.59 85.56 Favored Pre-proline 0 C--O 1.239 0.529 0 CA-C-N 118.365 1.083 . . . . 59.14 108.867 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.17 147.44 91.31 Favored 'Trans proline' 0 C--O 1.245 0.852 0 CA-C-N 118.858 0.628 . . . . 67.15 110.709 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -56.62 -37.58 97.31 Favored 'Trans proline' 0 C--O 1.236 0.422 0 N-CA-C 114.003 0.732 . . . . 85.42 114.003 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.5 p30 -72.44 -1.21 14.85 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.025 0.75 . . . . 86.94 113.025 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -108.26 5.38 25.62 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.403 0.547 . . . . 65.74 112.43 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -105.3 138.79 40.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 118.304 0.502 . . . . 59.17 110.609 -175.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -127.37 108.1 10.55 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 106.974 -1.491 . . . . 88.38 106.974 175.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 59.8 mt -100.15 129.49 46.18 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.623 -0.51 . . . . 75.3 109.623 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 4.0 mp -125.6 128.9 72.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.666 -0.864 . . . . 91.87 108.666 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -127.65 124.76 38.76 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.66 -0.867 . . . . 108.4 108.66 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.0 43.48 27.11 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.367 0.603 . . . . 112.56 111.531 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.53 4.59 84.92 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.952 1.141 . . . . 113.97 115.952 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -119.62 140.38 50.69 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.878 1.339 . . . . 137.1 109.94 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -77.98 140.92 39.23 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.05 0.452 . . . . 109.66 109.79 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 55.2 mt -97.33 144.54 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 98.03 110.787 -172.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -92.67 138.77 31.21 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.866 -0.606 . . . . 125.06 110.428 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -60.63 -44.3 96.51 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.806 -0.634 . . . . 99.03 112.002 -172.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.0 -18.55 79.69 Favored Glycine 0 C--N 1.335 0.494 0 CA-C-O 119.357 -0.69 . . . . 107.79 114.649 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -78.34 164.75 24.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 118.018 0.909 . . . . 133.53 110.462 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 5.6 p -100.47 167.64 10.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.941 0.876 . . . . 113.97 110.688 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.62 -39.86 94.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.051 -0.977 . . . . 103.45 111.347 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 86.8 p -69.09 -27.32 65.49 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.368 -0.533 . . . . 116.31 111.845 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.29 -37.45 83.23 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.261 -0.576 . . . . 121.88 111.165 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -88.2 6.52 36.31 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 112.812 0.671 . . . . 106.65 112.812 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.43 38.0 29.31 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.436 0.636 . . . . 139.28 111.146 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 74.5 mt -85.86 106.29 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 107.522 -1.288 . . . . 104.9 107.522 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -97.99 -174.8 2.96 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.752 0.787 . . . . 154.93 110.143 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.17 151.06 44.38 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.693 -0.685 . . . . 116.51 110.416 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' B' ' 2' ' ' GLN . 74.4 mt-10 64.76 7.79 4.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.833 1.253 . . . . 157.87 113.111 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -67.74 161.54 25.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.726 0.775 . . . . 105.99 110.455 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 97.8 m -122.04 107.08 11.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.481 -0.781 . . . . 104.05 109.302 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 10.2 mp -93.18 152.08 19.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.265 0.555 . . . . 81.2 109.892 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -108.26 137.67 45.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 82.8 109.976 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -112.21 126.64 55.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.805 -0.634 . . . . 59.94 109.614 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 57.7 t -123.06 133.32 69.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.585 -1.265 . . . . 77.22 107.585 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 49.3 mt -98.24 145.3 26.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.167 0.508 . . . . 64.14 110.527 -177.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 68.9 mtt85 -95.93 -19.22 19.69 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.22 1.193 . . . . 86.65 114.22 -172.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.08 126.79 28.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.708 0.685 . . . . 72.62 111.758 -166.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -129.64 157.13 42.96 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.385 1.074 . . . . 90.78 108.705 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.56 142.72 7.97 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 116.234 1.253 . . . . 68.93 116.234 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' NEH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . 0.525 ' O ' ' CD2' ' A' ' 125' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.53 0.308 0 N-CA-C 112.451 0.135 . . . . 94.5 112.451 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.9 p -75.14 -174.68 2.38 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.808 0.813 . . . . 104.19 109.803 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.7 t -103.55 113.43 40.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.383 -0.969 . . . . 74.32 108.383 -175.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -77.45 130.67 37.33 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.28 -0.637 . . . . 65.05 109.28 173.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -147.88 100.13 3.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.636 -0.875 . . . . 65.9 108.636 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.89 135.53 38.83 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.474 0.484 . . . . 64.14 110.47 172.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.7 mtm105 -119.21 151.52 38.23 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.292 0.568 . . . . 103.64 110.733 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.66 152.16 44.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.432 -0.804 . . . . 89.03 110.602 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.4 ptt-85 -70.28 149.54 47.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.505 -0.77 . . . . 110.73 109.575 171.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . 0.586 HD13 ' HA3' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -56.2 153.53 9.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.311 -0.859 . . . . 111.98 111.014 -176.293 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.25 -17.45 39.71 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.393 0.886 . . . . 94.81 113.393 -172.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt 58.16 38.24 26.35 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.598 0.636 . . . . 84.29 111.46 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 p -64.2 -32.48 74.08 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.961 -0.696 . . . . 45.94 111.781 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.37 89.62 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.235 -0.586 . . . . 46.53 111.274 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.91 -43.81 67.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 120.809 -0.356 . . . . 49.66 110.738 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -65.47 -36.69 84.63 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.927 -0.709 . . . . 60.49 111.245 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.46 -40.94 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.44 -0.504 . . . . 45.63 111.24 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.01 -48.77 80.25 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.131 -0.628 . . . . 43.2 110.827 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.56 -40.22 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.564 -0.454 . . . . 51.56 111.597 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.24 -38.59 81.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.842 -0.743 . . . . 51.09 111.49 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . 0.499 ' O ' ' NH1' ' A' ' 130' ' ' ARG . 1.2 p -69.69 -21.37 24.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.284 -0.966 . . . . 56.75 111.216 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.2 mt -99.99 -5.26 28.44 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.959 0.726 . . . . 50.79 112.959 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 58.53 44.41 17.89 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.1 0.56 . . . . 56.37 111.607 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -170.14 141.8 2.17 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.068 -0.715 . . . . 65.79 109.068 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -80.13 69.33 6.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.683 1.23 . . . . 70.96 109.151 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.46 -46.37 10.26 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.698 -1.137 . . . . 73.17 112.536 -174.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -103.1 161.0 14.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.882 0.849 . . . . 51.38 110.928 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.7 p -142.4 174.99 10.12 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 114.925 -1.034 . . . . 77.43 108.362 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -60.39 -33.46 72.5 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.689 -0.687 . . . . 78.69 110.974 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -70.36 -40.94 73.74 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.818 -0.353 . . . . 102.62 111.103 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.47 94.88 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.137 -0.625 . . . . 70.84 111.101 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.45 -46.21 87.32 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.565 -0.454 . . . . 65.91 111.008 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -62.21 -40.28 95.57 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.544 -0.462 . . . . 82.62 111.297 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -61.48 -40.88 96.14 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.559 -0.456 . . . . 113.08 111.087 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 90.3 mt -67.3 -40.25 84.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 C-N-CA 120.718 -0.393 . . . . 76.81 110.531 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 16.5 t -65.34 -20.8 66.56 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.6 0.592 . . . . 104.29 112.6 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mttm -67.6 -53.53 27.31 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.402 0.546 . . . . 110.6 111.292 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -74.56 -4.88 39.64 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.396 0.887 . . . . 104.6 113.396 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.3 mt -93.18 -10.97 33.88 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.998 0.74 . . . . 97.42 112.998 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 118.386 0.539 . . . . 108.94 111.066 179.339 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 121.775 0.798 . . . . 149.24 110.812 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . 0.586 ' HA3' HD13 ' A' ' 21' ' ' LEU . . . 70.8 4.76 55.25 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 115.635 1.014 . . . . 117.1 115.635 177.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -115.88 70.22 0.75 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.483 1.141 . . . . 106.48 107.935 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -75.1 141.94 43.71 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.224 0.535 . . . . 68.44 111.121 -170.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -87.65 179.32 6.54 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.73 0.776 . . . . 59.01 110.344 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -72.62 -21.2 19.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 115.837 -0.62 . . . . 52.1 111.549 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 51.4 m-20 -63.09 -40.56 98.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.555 -0.458 . . . . 58.09 111.086 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.71 -43.34 96.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.936 0.398 . . . . 52.77 110.541 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 39.9 mt -62.11 -44.02 98.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 O-C-N 121.968 -0.458 . . . . 54.06 110.62 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MSE . . . . . . . . . . . . . 45.8 mtt -62.92 -43.57 98.44 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.692 -0.63 . . . . 54.58 111.882 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.93 85.97 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.893 -0.594 . . . . 49.08 111.514 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.71 89.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.324 -0.55 . . . . 45.37 111.019 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.2 mt -67.02 -36.44 82.13 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.571 -0.452 . . . . 46.46 111.074 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.39 -37.32 85.28 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.825 -0.35 . . . . 80.9 111.349 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.05 -18.08 56.69 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.78 -0.724 . . . . 54.48 113.769 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.3 mt -103.21 17.31 24.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 117.677 0.739 . . . . 49.28 112.28 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.11 16.7 69.07 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.346 -0.931 . . . . 51.17 114.839 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 71.6 mt -106.22 -177.61 3.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.138 0.969 . . . . 46.22 109.538 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -157.23 153.6 27.83 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.342 -0.614 . . . . 45.79 109.342 -177.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.07 112.03 23.77 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.018 -1.105 . . . . 54.75 108.018 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 66.0 t -91.94 133.51 33.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.228 -1.027 . . . . 55.57 108.228 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -85.38 121.65 28.4 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.019 -0.734 . . . . 55.19 109.019 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 70.3 t-105 -77.11 128.68 34.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.554 -0.294 . . . . 64.2 110.448 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -73.13 113.18 9.89 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.883 -0.784 . . . . 67.19 108.883 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -59.96 -18.33 44.64 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.364 0.505 . . . . 123.35 112.364 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -76.1 -24.48 55.01 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.314 0.506 . . . . 84.77 111.971 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -70.65 146.33 93.51 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 120.749 -0.38 . . . . 103.36 110.917 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -65.73 142.98 72.47 Favored 'Trans proline' 0 C--N 1.333 -0.268 0 N-CA-C 110.203 -0.73 . . . . 74.87 110.203 170.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.2 mt -65.34 -18.21 65.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.771 -0.65 . . . . 80.62 112.384 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 63.6 p -65.26 -23.8 67.14 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.388 0.514 . . . . 82.62 112.388 175.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -79.88 -0.88 36.7 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.221 0.823 . . . . 89.56 113.221 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -92.33 111.67 23.33 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.881 -0.785 . . . . 71.23 108.881 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.13 80.47 9.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.416 1.103 . . . . 60.22 108.326 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.4 mt -53.58 -39.12 69.93 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.572 1.323 . . . . 57.44 114.572 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -57.79 -28.06 80.61 Favored 'Trans proline' 0 C--O 1.238 0.522 0 CA-C-N 121.57 1.596 . . . . 65.79 113.98 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -78.9 -5.89 54.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.997 0.74 . . . . 60.66 112.997 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 74.1 t -102.96 134.49 43.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.178 -0.675 . . . . 69.17 109.178 -173.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 67.5 mt -64.02 -42.15 97.22 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.268 -0.573 . . . . 66.95 110.969 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -178.23 179.72 48.45 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.389 -1.484 . . . . 45.57 109.389 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.4 mp -123.03 135.47 54.46 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.387 -0.598 . . . . 60.18 109.387 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 49.9 mt -111.63 115.35 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.002 -1.481 . . . . 42.23 107.002 170.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.95 157.38 16.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.628 0.728 . . . . 62.61 110.42 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -123.46 102.88 8.13 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.709 -1.589 . . . . 67.22 106.709 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 mt -111.22 151.74 43.33 Favored Pre-proline 0 N--CA 1.448 -0.526 0 C-N-CA 123.375 0.67 . . . . 69.49 110.682 -175.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.88 147.12 38.71 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-O 121.753 0.647 . . . . 75.93 111.512 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.36 104.43 50.04 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.111 -1.035 . . . . 103.4 109.1 175.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo . . . . . 0 C--O 1.212 -0.812 0 C-N-CA 122.251 1.968 . . . . 133.32 113.773 -179.013 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.866 0.365 . . . . 151.49 111.559 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -134.0 147.71 51.02 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.466 -0.568 . . . . 127.29 109.466 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 mtt-85 -132.97 155.81 48.46 Favored 'General case' 0 C--O 1.203 -1.349 0 CA-C-N 115.528 -0.76 . . . . 102.02 111.636 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HIS . . . . . 0.73 ' HD2' ' O ' ' A' ' 210' ' ' HOH . 6.2 p-80 -142.98 153.5 43.08 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 120.11 -0.636 . . . . 63.1 112.604 176.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -92.19 137.47 32.34 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 121.211 0.529 . . . . 52.65 112.019 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 77.3 t -136.72 138.69 46.0 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 O-C-N 122.196 -0.315 . . . . 52.48 111.552 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.92 134.62 41.51 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.086 0.554 . . . . 47.78 110.244 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 22.5 mt -115.02 136.23 53.35 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.113 -1.069 . . . . 72.81 108.113 165.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . 0.499 ' NH1' ' O ' ' A' ' 32' ' ' VAL . 12.9 tpt180 -153.58 138.49 17.17 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.815 -0.354 . . . . 69.57 110.073 -168.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . 0.411 HE21 ' HA2' ' A' ' 134' ' ' GLY . 9.3 tt0 -90.32 136.5 33.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.62 -0.718 . . . . 109.75 110.099 174.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.3 t -134.62 116.03 20.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.84 -1.17 . . . . 79.34 107.84 173.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.1 t70 56.02 37.78 29.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.465 0.65 . . . . 89.97 111.376 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . 0.411 ' HA2' HE21 ' A' ' 131' ' ' GLN . . . 90.44 -10.42 74.5 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 115.556 0.982 . . . . 93.72 115.556 174.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.78 125.54 62.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 118.653 1.227 . . . . 79.49 108.555 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -84.19 143.24 29.75 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.063 0.458 . . . . 68.95 110.466 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -128.03 144.53 51.11 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.837 -0.62 . . . . 74.84 110.113 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -86.11 106.58 17.34 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.186 -1.413 . . . . 64.92 107.186 165.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.67 31.74 2.23 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.276 0.473 . . . . 57.31 112.276 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASP . . . . . 0.492 ' HB3' ' HG ' ' A' ' 143' ' ' LEU . 34.3 t0 -49.26 123.13 6.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.801 0.334 . . . . 70.16 110.387 176.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 62.0 p -65.63 -17.1 64.34 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.533 0.568 . . . . 65.43 112.533 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -79.36 -13.01 59.91 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.764 0.653 . . . . 80.74 112.764 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . 0.492 ' HG ' ' HB3' ' A' ' 140' ' ' ASP . 88.2 mt -75.07 153.52 38.33 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.468 0.651 . . . . 81.49 110.475 176.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -81.16 -24.09 37.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.873 -0.731 . . . . 125.44 111.447 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -148.46 153.51 40.36 Favored Pre-proline 0 C--O 1.238 0.449 0 N-CA-C 107.882 -1.155 . . . . 78.71 107.882 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.21 145.01 99.12 Favored 'Trans proline' 0 C--N 1.333 -0.274 0 CA-C-O 121.783 0.66 . . . . 79.58 111.382 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.09 117.52 34.23 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.107 -0.951 . . . . 113.22 108.536 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.24 130.54 39.93 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.279 -0.419 . . . . 92.36 110.378 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 79.5 mt -103.79 -17.42 15.08 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.261 0.838 . . . . 87.86 113.261 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 102.33 -138.66 14.04 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 118.35 0.523 . . . . 79.24 113.588 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.76 -162.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.372 -0.603 . . . . 116.16 109.372 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 156' ' ' ARG . 43.2 mt-10 -61.9 -38.73 89.45 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.614 -0.434 . . . . 126.39 111.413 -178.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.37 -41.36 96.97 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 115.54 111.261 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -63.1 -48.92 75.99 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.159 -1.02 . . . . 102.17 112.658 -178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.08 -29.84 38.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 119.916 -0.714 . . . . 77.8 110.616 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 152' ' ' GLU . 8.2 ttm-85 -64.01 -39.77 94.85 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.746 -0.597 . . . . 98.28 110.974 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -36.98 82.79 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.242 -0.583 . . . . 88.26 110.9 173.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -60.34 -48.95 79.55 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.873 0.368 . . . . 80.81 110.905 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 42.7 mt -62.2 -43.62 98.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.653 -0.419 . . . . 79.36 111.333 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.46 86.77 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.335 -0.546 . . . . 95.72 111.226 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -72.87 -31.71 64.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.049 -0.661 . . . . 98.06 111.524 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -72.26 -38.59 68.83 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.156 -0.618 . . . . 94.9 111.184 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.8 -37.91 70.32 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.514 -0.474 . . . . 98.14 111.4 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -66.67 -25.54 66.61 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.134 -0.626 . . . . 113.04 111.592 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -66.57 -24.92 66.41 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.768 -0.373 . . . . 130.71 111.98 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 93.34 156.39 32.63 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.211 0.895 . . . . 114.27 112.538 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mp 62.28 37.12 14.25 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 114.686 -0.757 . . . . 107.97 111.71 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' CYS . . . . . . . . . . . . . 44.8 t -118.51 127.9 54.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.821 -0.437 . . . . 76.08 109.821 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -117.61 131.41 56.67 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.016 -0.735 . . . . 91.31 109.016 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.2 t -111.12 118.53 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 108.486 -0.931 . . . . 57.42 108.486 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 65.3 mt -106.6 136.5 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.142 -0.688 . . . . 51.52 109.142 173.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 51.8 mt -99.09 122.23 42.05 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.61 -0.885 . . . . 57.23 108.61 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.61 113.35 25.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 107.237 -1.394 . . . . 44.93 107.237 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 18.3 m -137.29 164.62 29.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.672 0.749 . . . . 48.89 109.413 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 44.7 p -71.21 164.71 25.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.304 -0.862 . . . . 52.38 110.302 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -63.08 -34.05 76.76 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 98.43 111.174 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -65.07 -47.22 78.09 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.735 0.302 . . . . 109.91 111.15 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.86 -33.12 59.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.596 -0.442 . . . . 59.75 110.824 178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -67.16 -44.21 80.31 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.746 -0.781 . . . . 65.96 111.228 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -63.99 -40.75 97.07 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.485 -0.486 . . . . 90.74 111.495 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.93 -19.59 51.4 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.865 0.691 . . . . 86.98 112.865 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . 65.6 22.14 69.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 119.994 -1.098 . . . . 64.54 114.127 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 78.4 p -74.65 -1.2 20.67 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.91 0.855 . . . . 72.74 112.946 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -69.45 -22.42 63.65 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.633 0.651 . . . . 57.7 111.556 167.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 63.8 tp -95.25 115.31 27.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.003 -0.74 . . . . 78.82 109.003 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.347 -0.388 . . . . 123.04 111.646 -178.458 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.751 0.31 . . . . 96.45 110.336 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -109.14 136.13 49.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.857 0.361 . . . . 101.57 110.394 -177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 pt -129.9 157.86 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 107.688 -1.227 . . . . 82.72 107.688 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -111.84 140.5 46.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.471 -0.786 . . . . 96.4 110.124 -177.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.6 t -118.6 117.81 55.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 107.665 -1.235 . . . . 62.75 107.665 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -103.93 133.0 49.64 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.304 -0.628 . . . . 104.12 109.304 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -104.14 166.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.811 0.815 . . . . 75.27 110.517 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.94 -18.48 65.37 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.296 -0.866 . . . . 100.66 112.749 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 54.5 p -89.49 11.25 19.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.672 0.619 . . . . 96.64 112.672 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.85 0.97 89.93 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.638 1.015 . . . . 79.44 115.638 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -76.77 151.96 35.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.709 1.255 . . . . 87.44 110.523 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 16.9 m -122.96 123.3 40.62 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.624 -0.88 . . . . 79.45 108.624 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mt -103.96 132.21 50.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 108.164 -1.05 . . . . 69.45 108.164 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.9 m -102.53 133.39 47.59 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.103 -0.702 . . . . 72.96 109.103 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -130.62 146.78 52.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.09 0.471 . . . . 70.85 109.985 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -104.01 120.94 42.14 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.991 -1.114 . . . . 88.08 107.991 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -140.84 172.62 10.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 121.835 0.826 . . . . 89.07 109.431 -172.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -125.06 151.84 69.67 Favored Pre-proline 0 N--CA 1.452 -0.345 0 C-N-CA 125.039 1.336 . . . . 98.35 109.419 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.46 -31.48 78.24 Favored 'Trans proline' 0 C--O 1.237 0.468 0 N-CA-C 113.386 0.495 . . . . 99.28 113.386 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 45.9 p -77.94 -6.94 56.01 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.208 0.818 . . . . 111.79 113.208 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.0 133.53 51.9 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.667 0.667 . . . . 104.2 109.941 175.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 60.5 p -76.1 161.67 28.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.726 0.774 . . . . 91.6 110.122 173.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 mm -57.59 -33.17 44.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.332 -0.849 . . . . 84.39 110.291 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.94 -38.39 90.91 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 121.942 -0.474 . . . . 87.08 111.311 175.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.78 -39.24 93.78 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.197 -0.601 . . . . 92.4 110.948 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 87.7 t -62.9 -43.25 98.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.691 -0.404 . . . . 65.72 110.283 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.33 -32.6 74.32 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.249 -0.581 . . . . 61.69 111.511 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.84 -37.37 81.81 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.377 -0.529 . . . . 61.36 111.228 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -69.65 -32.0 70.41 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.277 -0.569 . . . . 67.26 111.424 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -67.1 -35.6 74.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.499 -0.48 . . . . 53.15 110.329 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -66.12 -38.37 88.02 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 121.902 -0.499 . . . . 73.58 111.391 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.77 -38.98 90.06 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.306 -0.558 . . . . 69.18 111.379 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -86.41 -42.23 13.8 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.009 0.744 . . . . 64.1 113.009 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -104.78 -15.84 15.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.804 1.038 . . . . 75.73 113.804 -171.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 -1.65 84.85 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 119.132 -0.816 . . . . 66.59 114.931 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mt -74.08 121.59 85.56 Favored Pre-proline 0 C--O 1.239 0.529 0 CA-C-N 118.365 1.083 . . . . 59.14 108.867 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.17 147.44 91.31 Favored 'Trans proline' 0 C--O 1.245 0.852 0 CA-C-N 118.858 0.628 . . . . 67.15 110.709 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -56.62 -37.58 97.31 Favored 'Trans proline' 0 C--O 1.236 0.422 0 N-CA-C 114.003 0.732 . . . . 85.42 114.003 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.5 p30 -72.44 -1.21 14.85 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.025 0.75 . . . . 86.94 113.025 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -108.26 5.38 25.62 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.403 0.547 . . . . 65.74 112.43 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -105.3 138.79 40.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 118.304 0.502 . . . . 59.17 110.609 -175.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -127.37 108.1 10.55 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 106.974 -1.491 . . . . 88.38 106.974 175.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 59.8 mt -100.15 129.49 46.18 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.623 -0.51 . . . . 75.3 109.623 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 4.0 mp -125.6 128.9 72.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.666 -0.864 . . . . 91.87 108.666 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -127.65 124.76 38.76 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.66 -0.867 . . . . 108.4 108.66 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.0 43.48 27.11 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.367 0.603 . . . . 112.56 111.531 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.53 4.59 84.92 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.952 1.141 . . . . 113.97 115.952 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -119.62 140.38 50.69 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.878 1.339 . . . . 137.1 109.94 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -77.98 140.92 39.23 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.05 0.452 . . . . 109.66 109.79 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 55.2 mt -97.33 144.54 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 98.03 110.787 -172.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -92.67 138.77 31.21 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.866 -0.606 . . . . 125.06 110.428 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -60.63 -44.3 96.51 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.806 -0.634 . . . . 99.03 112.002 -172.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.0 -18.55 79.69 Favored Glycine 0 C--N 1.335 0.494 0 CA-C-O 119.357 -0.69 . . . . 107.79 114.649 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -78.34 164.75 24.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 118.018 0.909 . . . . 133.53 110.462 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 5.6 p -100.47 167.64 10.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.941 0.876 . . . . 113.97 110.688 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.62 -39.86 94.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.051 -0.977 . . . . 103.45 111.347 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 86.8 p -69.09 -27.32 65.49 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.368 -0.533 . . . . 116.31 111.845 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.29 -37.45 83.23 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.261 -0.576 . . . . 121.88 111.165 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -88.2 6.52 36.31 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 112.812 0.671 . . . . 106.65 112.812 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.43 38.0 29.31 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.436 0.636 . . . . 139.28 111.146 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 74.5 mt -85.86 106.29 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 107.522 -1.288 . . . . 104.9 107.522 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -97.99 -174.8 2.96 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.752 0.787 . . . . 154.93 110.143 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.17 151.06 44.38 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.693 -0.685 . . . . 116.51 110.416 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 64.76 7.79 4.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.833 1.253 . . . . 157.87 113.111 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -67.74 161.54 25.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.726 0.775 . . . . 105.99 110.455 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 97.8 m -122.04 107.08 11.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.481 -0.781 . . . . 104.05 109.302 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 10.2 mp -93.18 152.08 19.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.265 0.555 . . . . 81.2 109.892 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -108.26 137.67 45.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 82.8 109.976 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -112.21 126.64 55.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.805 -0.634 . . . . 59.94 109.614 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 57.7 t -123.06 133.32 69.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.585 -1.265 . . . . 77.22 107.585 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 49.3 mt -98.24 145.3 26.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.167 0.508 . . . . 64.14 110.527 -177.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 68.9 mtt85 -95.93 -19.22 19.69 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.22 1.193 . . . . 86.65 114.22 -172.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.08 126.79 28.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.708 0.685 . . . . 72.62 111.758 -166.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -129.64 157.13 42.96 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.385 1.074 . . . . 90.78 108.705 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.56 142.72 7.97 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 116.234 1.253 . . . . 68.93 116.234 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' NEH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . 0.73 ' O ' ' HD2' ' A' ' 125' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo . . . . . 0 CA--C 1.53 0.308 0 N-CA-C 112.451 0.135 . . . . 94.5 112.451 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 10.9 p -75.14 -174.68 2.38 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.808 0.813 . . . . 104.19 109.803 -176.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.7 t -103.55 113.43 40.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.383 -0.969 . . . . 74.32 108.383 -175.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -77.45 130.67 37.33 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.28 -0.637 . . . . 65.05 109.28 173.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 -147.88 100.13 3.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.636 -0.875 . . . . 65.9 108.636 -174.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -76.89 135.53 38.83 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.474 0.484 . . . . 64.14 110.47 172.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 45.7 mtm105 -119.21 151.52 38.23 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.292 0.568 . . . . 103.64 110.733 -179.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.66 152.16 44.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.432 -0.804 . . . . 89.03 110.602 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 12.4 ptt-85 -70.28 149.54 47.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.505 -0.77 . . . . 110.73 109.575 171.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.586 HD13 ' HA3' ' A' ' 66' ' ' GLY . 0.7 OUTLIER -56.2 153.53 9.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.311 -0.859 . . . . 111.98 111.014 -176.293 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.25 -17.45 39.71 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.393 0.886 . . . . 94.81 113.393 -172.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 60.8 mt 58.16 38.24 26.35 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 118.598 0.636 . . . . 84.29 111.46 -176.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 27.5 p -64.2 -32.48 74.08 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.961 -0.696 . . . . 45.94 111.781 -174.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.5 -38.37 89.62 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.235 -0.586 . . . . 46.53 111.274 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.91 -43.81 67.98 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 120.809 -0.356 . . . . 49.66 110.738 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -65.47 -36.69 84.63 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.927 -0.709 . . . . 60.49 111.245 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.46 -40.94 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.44 -0.504 . . . . 45.63 111.24 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 31.1 mt -61.01 -48.77 80.25 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.131 -0.628 . . . . 43.2 110.827 175.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -67.56 -40.22 84.95 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.564 -0.454 . . . . 51.56 111.597 -176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.24 -38.59 81.99 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.842 -0.743 . . . . 51.09 111.49 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.499 ' O ' ' NH1' ' A' ' 130' ' ' ARG . 1.2 p -69.69 -21.37 24.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.284 -0.966 . . . . 56.75 111.216 179.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.2 mt -99.99 -5.26 28.44 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.959 0.726 . . . . 50.79 112.959 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 54.8 mm-40 58.53 44.41 17.89 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.1 0.56 . . . . 56.37 111.607 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -170.14 141.8 2.17 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.068 -0.715 . . . . 65.79 109.068 -176.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -80.13 69.33 6.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.683 1.23 . . . . 70.96 109.151 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.46 -46.37 10.26 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.698 -1.137 . . . . 73.17 112.536 -174.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -103.1 161.0 14.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.882 0.849 . . . . 51.38 110.928 -173.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.7 p -142.4 174.99 10.12 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 114.925 -1.034 . . . . 77.43 108.362 -178.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -60.39 -33.46 72.5 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.689 -0.687 . . . . 78.69 110.974 173.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -70.36 -40.94 73.74 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.818 -0.353 . . . . 102.62 111.103 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.03 -40.47 94.88 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.137 -0.625 . . . . 70.84 111.101 176.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.45 -46.21 87.32 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.565 -0.454 . . . . 65.91 111.008 178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 92.6 m-20 -62.21 -40.28 95.57 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.544 -0.462 . . . . 82.62 111.297 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -61.48 -40.88 96.14 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.559 -0.456 . . . . 113.08 111.087 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 90.3 mt -67.3 -40.25 84.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 C-N-CA 120.718 -0.393 . . . . 76.81 110.531 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 16.5 t -65.34 -20.8 66.56 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.6 0.592 . . . . 104.29 112.6 -178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.6 mttm -67.6 -53.53 27.31 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.402 0.546 . . . . 110.6 111.292 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 ptt85 -74.56 -4.88 39.64 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 113.396 0.887 . . . . 104.6 113.396 -171.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 66.3 mt -93.18 -10.97 33.88 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.998 0.74 . . . . 97.42 112.998 176.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 118.386 0.539 . . . . 108.94 111.066 179.339 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 121.775 0.798 . . . . 149.24 110.812 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.586 ' HA3' HD13 ' A' ' 21' ' ' LEU . . . 70.8 4.76 55.25 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 115.635 1.014 . . . . 117.1 115.635 177.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -115.88 70.22 0.75 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.483 1.141 . . . . 106.48 107.935 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -75.1 141.94 43.71 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.224 0.535 . . . . 68.44 111.121 -170.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -87.65 179.32 6.54 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.73 0.776 . . . . 59.01 110.344 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 12.7 p -72.62 -21.2 19.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-N 115.837 -0.62 . . . . 52.1 111.549 -178.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 51.4 m-20 -63.09 -40.56 98.01 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.555 -0.458 . . . . 58.09 111.086 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.71 -43.34 96.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.936 0.398 . . . . 52.77 110.541 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 39.9 mt -62.11 -44.02 98.5 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 O-C-N 121.968 -0.458 . . . . 54.06 110.62 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MSE . . . . . . . . . . . . . 45.8 mtt -62.92 -43.57 98.44 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.692 -0.63 . . . . 54.58 111.882 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.58 -37.93 85.97 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.893 -0.594 . . . . 49.08 111.514 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.71 89.61 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.324 -0.55 . . . . 45.37 111.019 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.2 mt -67.02 -36.44 82.13 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.571 -0.452 . . . . 46.46 111.074 179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -62.39 -37.32 85.28 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.825 -0.35 . . . . 80.9 111.349 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.05 -18.08 56.69 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.78 -0.724 . . . . 54.48 113.769 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.3 mt -103.21 17.31 24.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 117.677 0.739 . . . . 49.28 112.28 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 68.11 16.7 69.07 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.346 -0.931 . . . . 51.17 114.839 -176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 71.6 mt -106.22 -177.61 3.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.138 0.969 . . . . 46.22 109.538 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -157.23 153.6 27.83 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 109.342 -0.614 . . . . 45.79 109.342 -177.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -110.07 112.03 23.77 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 108.018 -1.105 . . . . 54.75 108.018 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 66.0 t -91.94 133.51 33.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.228 -1.027 . . . . 55.57 108.228 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -85.38 121.65 28.4 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.019 -0.734 . . . . 55.19 109.019 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 70.3 t-105 -77.11 128.68 34.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.554 -0.294 . . . . 64.2 110.448 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -73.13 113.18 9.89 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.883 -0.784 . . . . 67.19 108.883 175.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -59.96 -18.33 44.64 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.364 0.505 . . . . 123.35 112.364 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -76.1 -24.48 55.01 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 118.314 0.506 . . . . 84.77 111.971 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtt-85 -70.65 146.33 93.51 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 120.749 -0.38 . . . . 103.36 110.917 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -65.73 142.98 72.47 Favored 'Trans proline' 0 C--N 1.333 -0.268 0 N-CA-C 110.203 -0.73 . . . . 74.87 110.203 170.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.2 mt -65.34 -18.21 65.13 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.771 -0.65 . . . . 80.62 112.384 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 63.6 p -65.26 -23.8 67.14 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.388 0.514 . . . . 82.62 112.388 175.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -79.88 -0.88 36.7 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.221 0.823 . . . . 89.56 113.221 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 21.3 tp -92.33 111.67 23.33 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.881 -0.785 . . . . 71.23 108.881 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.13 80.47 9.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 122.416 1.103 . . . . 60.22 108.326 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.4 mt -53.58 -39.12 69.93 Favored Pre-proline 0 C--O 1.243 0.724 0 N-CA-C 114.572 1.323 . . . . 57.44 114.572 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -57.79 -28.06 80.61 Favored 'Trans proline' 0 C--O 1.238 0.522 0 CA-C-N 121.57 1.596 . . . . 65.79 113.98 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 66.4 mm-40 -78.9 -5.89 54.79 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.997 0.74 . . . . 60.66 112.997 179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 74.1 t -102.96 134.49 43.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 109.178 -0.675 . . . . 69.17 109.178 -173.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 67.5 mt -64.02 -42.15 97.22 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 120.268 -0.573 . . . . 66.95 110.969 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -178.23 179.72 48.45 Favored Glycine 0 N--CA 1.449 -0.437 0 N-CA-C 109.389 -1.484 . . . . 45.57 109.389 178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 7.4 mp -123.03 135.47 54.46 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.387 -0.598 . . . . 60.18 109.387 -177.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 49.9 mt -111.63 115.35 49.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.002 -1.481 . . . . 42.23 107.002 170.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.95 157.38 16.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.628 0.728 . . . . 62.61 110.42 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -123.46 102.88 8.13 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.709 -1.589 . . . . 67.22 106.709 170.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 mt -111.22 151.74 43.33 Favored Pre-proline 0 N--CA 1.448 -0.526 0 C-N-CA 123.375 0.67 . . . . 69.49 110.682 -175.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.88 147.12 38.71 Favored 'Trans proline' 0 C--N 1.33 -0.434 0 CA-C-O 121.753 0.647 . . . . 75.93 111.512 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.36 104.43 50.04 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.111 -1.035 . . . . 103.4 109.1 175.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo . . . . . 0 C--O 1.212 -0.812 0 C-N-CA 122.251 1.968 . . . . 133.32 113.773 -179.013 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 62.3 mtp180 . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.866 0.365 . . . . 151.49 111.559 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 20.1 mmm-85 -134.0 147.71 51.02 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.466 -0.568 . . . . 127.29 109.466 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 62.9 mtt-85 -132.97 155.81 48.46 Favored 'General case' 0 C--O 1.203 -1.349 0 CA-C-N 115.528 -0.76 . . . . 102.02 111.636 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.73 ' HD2' ' O ' ' A' ' 210' ' ' HOH . 6.2 p-80 -142.98 153.5 43.08 Favored 'General case' 0 C--O 1.198 -1.629 0 C-N-CA 120.11 -0.636 . . . . 63.1 112.604 176.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -92.19 137.47 32.34 Favored 'General case' 0 C--O 1.19 -2.039 0 CA-C-O 121.211 0.529 . . . . 52.65 112.019 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 77.3 t -136.72 138.69 46.0 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.094 0 O-C-N 122.196 -0.315 . . . . 52.48 111.552 -178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -98.92 134.62 41.51 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 123.086 0.554 . . . . 47.78 110.244 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 22.5 mt -115.02 136.23 53.35 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.113 -1.069 . . . . 72.81 108.113 165.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.499 ' NH1' ' O ' ' A' ' 32' ' ' VAL . 12.9 tpt180 -153.58 138.49 17.17 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.815 -0.354 . . . . 69.57 110.073 -168.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.411 HE21 ' HA2' ' A' ' 134' ' ' GLY . 9.3 tt0 -90.32 136.5 33.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.62 -0.718 . . . . 109.75 110.099 174.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 98.3 t -134.62 116.03 20.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.84 -1.17 . . . . 79.34 107.84 173.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.1 t70 56.02 37.78 29.22 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.465 0.65 . . . . 89.97 111.376 -178.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.411 ' HA2' HE21 ' A' ' 131' ' ' GLN . . . 90.44 -10.42 74.5 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 115.556 0.982 . . . . 93.72 115.556 174.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 75.4 t -106.78 125.54 62.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-N 118.653 1.227 . . . . 79.49 108.555 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -84.19 143.24 29.75 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 121.063 0.458 . . . . 68.95 110.466 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -128.03 144.53 51.11 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.837 -0.62 . . . . 74.84 110.113 -179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -86.11 106.58 17.34 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 107.186 -1.413 . . . . 64.92 107.186 165.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.67 31.74 2.23 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.276 0.473 . . . . 57.31 112.276 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.492 ' HB3' ' HG ' ' A' ' 143' ' ' LEU . 34.3 t0 -49.26 123.13 6.89 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 120.801 0.334 . . . . 70.16 110.387 176.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 62.0 p -65.63 -17.1 64.34 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 112.533 0.568 . . . . 65.43 112.533 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -79.36 -13.01 59.91 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.764 0.653 . . . . 80.74 112.764 175.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . 0.492 ' HG ' ' HB3' ' A' ' 140' ' ' ASP . 88.2 mt -75.07 153.52 38.33 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.468 0.651 . . . . 81.49 110.475 176.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -81.16 -24.09 37.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.873 -0.731 . . . . 125.44 111.447 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -148.46 153.51 40.36 Favored Pre-proline 0 C--O 1.238 0.449 0 N-CA-C 107.882 -1.155 . . . . 78.71 107.882 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -61.21 145.01 99.12 Favored 'Trans proline' 0 C--N 1.333 -0.274 0 CA-C-O 121.783 0.66 . . . . 79.58 111.382 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -106.09 117.52 34.23 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.107 -0.951 . . . . 113.22 108.536 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . -74.24 130.54 39.93 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.279 -0.419 . . . . 92.36 110.378 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 79.5 mt -103.79 -17.42 15.08 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.261 0.838 . . . . 87.86 113.261 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 102.33 -138.66 14.04 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 118.35 0.523 . . . . 79.24 113.588 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 34.6 p-10 -92.76 -162.82 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.372 -0.603 . . . . 116.16 109.372 -178.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 156' ' ' ARG . 43.2 mt-10 -61.9 -38.73 89.45 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.614 -0.434 . . . . 126.39 111.413 -178.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -61.37 -41.36 96.97 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 115.54 111.261 178.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLY . . . . . . . . . . . . . . . -63.1 -48.92 75.99 Favored Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.159 -1.02 . . . . 102.17 112.658 -178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.08 -29.84 38.47 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 119.916 -0.714 . . . . 77.8 110.616 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 152' ' ' GLU . 8.2 ttm-85 -64.01 -39.77 94.85 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 121.746 -0.597 . . . . 98.28 110.974 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -67.24 -36.98 82.79 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.242 -0.583 . . . . 88.26 110.9 173.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -60.34 -48.95 79.55 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.873 0.368 . . . . 80.81 110.905 175.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 42.7 mt -62.2 -43.62 98.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.653 -0.419 . . . . 79.36 111.333 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.46 86.77 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.335 -0.546 . . . . 95.72 111.226 178.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -72.87 -31.71 64.91 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.049 -0.661 . . . . 98.06 111.524 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -72.26 -38.59 68.83 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.156 -0.618 . . . . 94.9 111.184 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.8 -37.91 70.32 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.514 -0.474 . . . . 98.14 111.4 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . -66.67 -25.54 66.61 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.134 -0.626 . . . . 113.04 111.592 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -66.57 -24.92 66.41 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.768 -0.373 . . . . 130.71 111.98 174.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . 93.34 156.39 32.63 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 122.211 0.895 . . . . 114.27 112.538 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 7.3 mp 62.28 37.12 14.25 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 114.686 -0.757 . . . . 107.97 111.71 174.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' CYS . . . . . . . . . . . . . 44.8 t -118.51 127.9 54.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.821 -0.437 . . . . 76.08 109.821 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -117.61 131.41 56.67 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.016 -0.735 . . . . 91.31 109.016 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 80.2 t -111.12 118.53 57.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 N-CA-C 108.486 -0.931 . . . . 57.42 108.486 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' LEU . . . . . . . . . . . . . 65.3 mt -106.6 136.5 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.142 -0.688 . . . . 51.52 109.142 173.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 51.8 mt -99.09 122.23 42.05 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.61 -0.885 . . . . 57.23 108.61 177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -89.61 113.35 25.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 107.237 -1.394 . . . . 44.93 107.237 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' VAL . . . . . . . . . . . . . 18.3 m -137.29 164.62 29.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-O 121.672 0.749 . . . . 48.89 109.413 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 44.7 p -71.21 164.71 25.13 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.304 -0.862 . . . . 52.38 110.302 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -63.08 -34.05 76.76 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.295 -0.866 . . . . 98.43 111.174 176.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -65.07 -47.22 78.09 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.735 0.302 . . . . 109.91 111.15 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 41.0 t -63.86 -33.12 59.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.507 0 C-N-CA 120.596 -0.442 . . . . 59.75 110.824 178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 47.5 tt0 -67.16 -44.21 80.31 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.746 -0.781 . . . . 65.96 111.228 176.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -63.99 -40.75 97.07 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.485 -0.486 . . . . 90.74 111.495 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' LYS . . . . . . . . . . . . . 52.7 mttm -78.93 -19.59 51.4 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.865 0.691 . . . . 86.98 112.865 -178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . 65.6 22.14 69.53 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 119.994 -1.098 . . . . 64.54 114.127 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' SER . . . . . . . . . . . . . 78.4 p -74.65 -1.2 20.67 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 117.91 0.855 . . . . 72.74 112.946 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -69.45 -22.42 63.65 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.633 0.651 . . . . 57.7 111.556 167.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 63.8 tp -95.25 115.31 27.26 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.003 -0.74 . . . . 78.82 109.003 178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.347 -0.388 . . . . 123.04 111.646 -178.458 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.751 0.31 . . . . 96.45 110.336 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -109.14 136.13 49.13 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.857 0.361 . . . . 101.57 110.394 -177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 37.2 pt -129.9 157.86 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 107.688 -1.227 . . . . 82.72 107.688 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -111.84 140.5 46.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.471 -0.786 . . . . 96.4 110.124 -177.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.6 t -118.6 117.81 55.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 N-CA-C 107.665 -1.235 . . . . 62.75 107.665 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -103.93 133.0 49.64 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.304 -0.628 . . . . 104.12 109.304 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -104.14 166.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.811 0.815 . . . . 75.27 110.517 -178.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.94 -18.48 65.37 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.296 -0.866 . . . . 100.66 112.749 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 54.5 p -89.49 11.25 19.95 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 112.672 0.619 . . . . 96.64 112.672 177.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.85 0.97 89.93 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 115.638 1.015 . . . . 79.44 115.638 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt -76.77 151.96 35.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 118.709 1.255 . . . . 87.44 110.523 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 16.9 m -122.96 123.3 40.62 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.624 -0.88 . . . . 79.45 108.624 175.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 28.2 mt -103.96 132.21 50.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 N-CA-C 108.164 -1.05 . . . . 69.45 108.164 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 94.9 m -102.53 133.39 47.59 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 109.103 -0.702 . . . . 72.96 109.103 176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 80.0 mt -130.62 146.78 52.2 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.09 0.471 . . . . 70.85 109.985 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 40.1 tp10 -104.01 120.94 42.14 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.991 -1.114 . . . . 88.08 107.991 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 17.3 m -140.84 172.62 10.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.15 0 CA-C-O 121.835 0.826 . . . . 89.07 109.431 -172.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -125.06 151.84 69.67 Favored Pre-proline 0 N--CA 1.452 -0.345 0 C-N-CA 125.039 1.336 . . . . 98.35 109.419 172.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -55.46 -31.48 78.24 Favored 'Trans proline' 0 C--O 1.237 0.468 0 N-CA-C 113.386 0.495 . . . . 99.28 113.386 177.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 45.9 p -77.94 -6.94 56.01 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.208 0.818 . . . . 111.79 113.208 178.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.0 133.53 51.9 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.667 0.667 . . . . 104.2 109.941 175.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 60.5 p -76.1 161.67 28.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.726 0.774 . . . . 91.6 110.122 173.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 mm -57.59 -33.17 44.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.332 -0.849 . . . . 84.39 110.291 174.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.6 tp10 -63.94 -38.39 90.91 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 121.942 -0.474 . . . . 87.08 111.311 175.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -63.78 -39.24 93.78 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.197 -0.601 . . . . 92.4 110.948 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 87.7 t -62.9 -43.25 98.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 120.691 -0.404 . . . . 65.72 110.283 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.33 -32.6 74.32 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.249 -0.581 . . . . 61.69 111.511 176.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.84 -37.37 81.81 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.377 -0.529 . . . . 61.36 111.228 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -69.65 -32.0 70.41 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.277 -0.569 . . . . 67.26 111.424 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -67.1 -35.6 74.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 C-N-CA 120.499 -0.48 . . . . 53.15 110.329 173.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -66.12 -38.37 88.02 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 121.902 -0.499 . . . . 73.58 111.391 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -61.77 -38.98 90.06 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.306 -0.558 . . . . 69.18 111.379 -179.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -86.41 -42.23 13.8 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 113.009 0.744 . . . . 64.1 113.009 -177.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -104.78 -15.84 15.1 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.804 1.038 . . . . 75.73 113.804 -171.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 81.43 -1.65 84.85 Favored Glycine 0 N--CA 1.446 -0.672 0 CA-C-O 119.132 -0.816 . . . . 66.59 114.931 -176.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mt -74.08 121.59 85.56 Favored Pre-proline 0 C--O 1.239 0.529 0 CA-C-N 118.365 1.083 . . . . 59.14 108.867 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.17 147.44 91.31 Favored 'Trans proline' 0 C--O 1.245 0.852 0 CA-C-N 118.858 0.628 . . . . 67.15 110.709 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -56.62 -37.58 97.31 Favored 'Trans proline' 0 C--O 1.236 0.422 0 N-CA-C 114.003 0.732 . . . . 85.42 114.003 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.5 p30 -72.44 -1.21 14.85 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 113.025 0.75 . . . . 86.94 113.025 -177.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -108.26 5.38 25.62 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.403 0.547 . . . . 65.74 112.43 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -105.3 138.79 40.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 118.304 0.502 . . . . 59.17 110.609 -175.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -127.37 108.1 10.55 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 106.974 -1.491 . . . . 88.38 106.974 175.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 59.8 mt -100.15 129.49 46.18 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.623 -0.51 . . . . 75.3 109.623 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 4.0 mp -125.6 128.9 72.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 108.666 -0.864 . . . . 91.87 108.666 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -127.65 124.76 38.76 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.66 -0.867 . . . . 108.4 108.66 176.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.0 43.48 27.11 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.367 0.603 . . . . 112.56 111.531 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 77.53 4.59 84.92 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.952 1.141 . . . . 113.97 115.952 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 27.9 mttp -119.62 140.38 50.69 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 118.878 1.339 . . . . 137.1 109.94 179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -77.98 140.92 39.23 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.05 0.452 . . . . 109.66 109.79 174.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 55.2 mt -97.33 144.54 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.977 -0.556 . . . . 98.03 110.787 -172.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -92.67 138.77 31.21 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.866 -0.606 . . . . 125.06 110.428 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -60.63 -44.3 96.51 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.806 -0.634 . . . . 99.03 112.002 -172.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -74.0 -18.55 79.69 Favored Glycine 0 C--N 1.335 0.494 0 CA-C-O 119.357 -0.69 . . . . 107.79 114.649 -174.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -78.34 164.75 24.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 118.018 0.909 . . . . 133.53 110.462 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 5.6 p -100.47 167.64 10.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.941 0.876 . . . . 113.97 110.688 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 15.8 mt -64.62 -39.86 94.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.051 -0.977 . . . . 103.45 111.347 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 86.8 p -69.09 -27.32 65.49 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.368 -0.533 . . . . 116.31 111.845 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.29 -37.45 83.23 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.261 -0.576 . . . . 121.88 111.165 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -88.2 6.52 36.31 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 112.812 0.671 . . . . 106.65 112.812 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 7.2 t30 56.43 38.0 29.31 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 121.436 0.636 . . . . 139.28 111.146 -178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 74.5 mt -85.86 106.29 15.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 107.522 -1.288 . . . . 104.9 107.522 175.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -97.99 -174.8 2.96 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.752 0.787 . . . . 154.93 110.143 -175.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -64.17 151.06 44.38 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.693 -0.685 . . . . 116.51 110.416 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 74.4 mt-10 64.76 7.79 4.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.833 1.253 . . . . 157.87 113.111 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -67.74 161.54 25.8 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.726 0.775 . . . . 105.99 110.455 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 97.8 m -122.04 107.08 11.8 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.481 -0.781 . . . . 104.05 109.302 -174.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 10.2 mp -93.18 152.08 19.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.265 0.555 . . . . 81.2 109.892 175.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -108.26 137.67 45.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.786 -0.643 . . . . 82.8 109.976 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -112.21 126.64 55.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.805 -0.634 . . . . 59.94 109.614 -178.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 57.7 t -123.06 133.32 69.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.585 -1.265 . . . . 77.22 107.585 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 49.3 mt -98.24 145.3 26.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.167 0.508 . . . . 64.14 110.527 -177.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 68.9 mtt85 -95.93 -19.22 19.69 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 114.22 1.193 . . . . 86.65 114.22 -172.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.08 126.79 28.63 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.708 0.685 . . . . 72.62 111.758 -166.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -129.64 157.13 42.96 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 124.385 1.074 . . . . 90.78 108.705 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.56 142.72 7.97 Favored Glycine 0 C--N 1.331 0.268 0 N-CA-C 116.234 1.253 . . . . 68.93 116.234 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' NEH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . 0.73 ' O ' ' HD2' ' A' ' 125' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_