data_6abt_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 6abt _Structure_validation_residue.Date_analyzed 2019-05-31 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 ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 113.347 0.869 . . . . 115.08 113.347 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . 0.356 0.0 OUTLIER -153.18 31.04 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 120.148 3.388 . . . . 106.85 120.148 -178.87 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -52.44 -27.65 16.84 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 113.221 0.823 . . . . 94.42 113.221 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.43 -44.92 97.11 Favored Glycine 0 N--CA 1.476 1.321 0 N-CA-C 114.191 0.437 . . . . 91.65 114.191 173.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 21.5 m -67.4 -26.3 66.37 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.125 1.528 . . . . 92.38 115.125 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 tp -46.24 -44.14 16.05 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.067 1.506 . . . . 99.24 115.067 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -60.56 -33.6 72.93 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.248 0.462 . . . . 133.4 112.248 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.81 -30.17 8.16 Favored Glycine 0 N--CA 1.477 1.394 0 N-CA-C 115.837 1.095 . . . . 97.85 115.837 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 6.2 mmt -53.41 -41.58 66.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.044 0.938 . . . . 95.6 113.23 164.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ILE . . . . . . . . . . . . . 58.0 mt -67.2 -47.04 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 123.435 0.694 . . . . 72.41 112.368 177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.6 mt -61.44 -31.93 71.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.535 0.734 . . . . 70.78 111.742 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.37 -47.42 85.48 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 112.833 0.679 . . . . 87.88 112.833 170.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -65.85 -42.26 90.69 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.938 0.348 . . . . 82.09 111.938 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.54 -21.71 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 111.885 0.328 . . . . 73.69 111.885 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 82.8 p -73.23 -11.64 60.58 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 115.369 1.618 . . . . 83.24 115.369 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.99 44.44 2.32 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 114.176 1.176 . . . . 100.91 114.176 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.44 146.62 7.28 Favored Glycine 0 N--CA 1.476 1.348 0 N-CA-C 116.713 1.445 . . . . 85.13 116.713 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -47.56 128.06 12.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.724 0.809 . . . . 91.76 109.414 171.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -144.98 175.95 9.84 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.798 -0.637 . . . . 75.86 112.271 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -143.86 152.11 40.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 109.432 -0.581 . . . . 84.12 109.432 -170.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -34.85 -49.01 0.75 Allowed Glycine 0 N--CA 1.466 0.642 0 N-CA-C 116.602 1.401 . . . . 69.57 116.602 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -61.98 -53.91 49.03 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 114.333 1.234 . . . . 78.9 114.333 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.68 -43.6 93.95 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.356 0.41 . . . . 84.31 111.058 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . 0.481 0.0 OUTLIER -63.4 -42.33 95.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 N-CA-C 113.731 1.012 . . . . 72.98 113.731 174.075 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 5.4 m -61.36 -43.24 99.21 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.787 0.662 . . . . 76.7 112.787 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -61.85 -42.35 98.94 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.442 -0.345 . . . . 91.49 111.711 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -62.02 -39.9 93.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.413 0.523 . . . . 94.4 112.413 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -66.4 -36.42 82.79 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.849 0.718 . . . . 96.19 112.863 174.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -67.77 -40.89 83.99 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.425 1.09 . . . . 105.68 111.435 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.93 -35.32 80.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.942 1.09 . . . . 91.77 113.942 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 48.7 mt -67.05 -10.44 49.91 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 114.125 1.157 . . . . 102.82 114.125 175.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 115.19 -12.11 19.63 Favored Glycine 0 C--N 1.335 0.506 0 O-C-N 123.407 0.442 . . . . 98.42 113.774 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -88.52 76.15 8.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.223 0.535 . . . . 113.35 110.556 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.88 -15.14 39.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.42 1.637 . . . . 108.79 115.42 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 pm0 -55.4 -27.55 48.36 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.204 1.928 . . . . 109.09 116.204 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 2.0 pp -88.19 146.59 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 114.418 1.266 . . . . 99.16 114.418 -175.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 11.4 t -109.23 155.06 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.689 -0.856 . . . . 92.07 108.689 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -33.1 -50.02 0.27 Allowed 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.866 0.691 . . . . 90.76 112.866 172.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.5 -52.4 50.39 Favored Glycine 0 C--N 1.336 0.528 0 N-CA-C 117.275 1.67 . . . . 84.84 117.275 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 4.2 m -43.81 -37.65 2.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.831 1.252 . . . . 86.24 113.971 168.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.45 -51.34 25.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 122.528 0.331 . . . . 79.77 110.724 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -57.81 -35.02 70.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.594 0.59 . . . . 85.07 112.594 176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 6.4 t -75.42 -14.62 60.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.381 0.511 . . . . 100.47 112.381 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 49.5 mt -93.26 -35.89 6.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 115.839 -0.618 . . . . 81.6 109.587 167.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.09 -33.35 73.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.969 0.729 . . . . 72.26 112.969 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 7.5 t -70.54 -49.65 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.287 -1.375 . . . . 83.26 107.287 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 22.4 ttm180 -50.38 -50.02 52.75 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.294 -0.866 . . . . 103.08 111.186 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -23.64 65.9 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.732 1.752 . . . . 79.55 115.732 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -80.08 -45.41 18.31 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.817 -0.438 . . . . 106.71 109.817 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -51.49 -47.6 63.17 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 124.198 0.936 . . . . 99.72 110.381 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -76.96 -10.41 59.34 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.44 1.096 . . . . 100.3 111.096 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.66 18.35 61.97 Favored Glycine 0 C--O 1.242 0.656 0 N-CA-C 118.436 2.134 . . . . 72.42 118.436 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mt -95.45 -2.25 49.18 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.569 1.322 . . . . 68.91 114.569 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.3 m -129.83 152.23 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.454 0.539 . . . . 69.92 112.454 175.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -109.82 153.68 24.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.255 -0.43 . . . . 90.69 110.14 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 44.8 mm -121.15 117.2 52.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 115.838 -0.619 . . . . 75.22 112.447 -167.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.99 100.35 9.71 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 106.605 -1.628 . . . . 93.96 106.605 164.52 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -73.34 124.91 26.66 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.615 -0.883 . . . . 81.71 108.615 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . . . -118.07 123.98 46.97 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 116.495 -0.32 . . . . 68.61 110.163 -174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . . . -85.48 161.25 19.46 Favored 'General case' 0 CA--C 1.561 1.371 0 N-CA-C 114.624 1.342 . . . . 70.61 114.624 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.3 t -146.2 138.33 25.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.674 1.189 . . . . 74.57 109.849 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.93 -9.52 55.45 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.489 -0.93 . . . . 86.32 108.489 166.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . . . -92.87 -32.27 14.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.269 0.628 . . . . 96.08 112.573 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -153.11 -160.04 9.45 Favored Glycine 0 N--CA 1.487 2.049 0 C-N-CA 124.405 1.002 . . . . 88.84 114.9 169.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -75.26 167.64 26.36 Favored 'Trans proline' 0 C--N 1.364 1.391 0 C-N-CA 124.677 3.585 . . . . 90.03 111.893 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -77.13 133.21 13.3 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 117.127 -1.448 . . . . 78.21 114.298 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . . . -102.06 148.11 25.77 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 107.48 -1.304 . . . . 71.97 107.48 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -95.88 136.81 35.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.152 0.581 . . . . 69.2 111.33 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -110.88 131.81 54.73 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.952 -0.299 . . . . 71.78 111.032 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.48 139.23 42.31 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 115.736 1.754 . . . . 76.9 115.736 -166.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -137.55 148.67 46.13 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.83 -1.532 . . . . 65.28 107.942 -177.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.64 133.62 45.81 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 119.783 -0.767 . . . . 63.83 111.149 173.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 21.9 p -80.6 167.7 30.81 Favored Pre-proline 0 C--O 1.237 0.432 0 N-CA-C 107.6 -1.259 . . . . 66.73 107.6 169.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.57 -34.08 96.79 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 114.457 -3.229 . . . . 76.37 113.202 173.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.25 96.39 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.43 0.456 . . . . 70.31 111.858 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.38 -38.43 58.3 Favored Glycine 0 N--CA 1.469 0.856 0 CA-C-N 115.647 -0.706 . . . . 66.34 112.726 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -51.75 -50.25 60.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.707 0.403 . . . . 94.96 109.983 166.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -61.97 -48.05 82.09 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.206 1.928 . . . . 77.74 116.206 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -40.5 94.19 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 117.947 0.339 . . . . 90.86 111.887 -176.003 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.65 -45.06 90.15 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.38 0.272 . . . . 66.51 111.507 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -51.13 -43.64 61.22 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 118.864 -0.589 . . . . 68.52 111.173 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 5.5 mt -67.93 -50.72 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-N 118.067 0.394 . . . . 77.08 111.845 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -43.49 -50.81 6.99 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.133 0.973 . . . . 74.09 113.014 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -62.95 -45.01 94.5 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.644 1.349 . . . . 72.05 114.644 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . . . -57.28 -37.63 72.7 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.518 0.727 . . . . 77.82 111.783 171.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . . . -62.32 -41.65 98.73 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.166 0.432 . . . . 71.82 112.166 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -65.51 -51.36 60.57 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.156 0.799 . . . . 77.69 113.156 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -48.43 -47.96 37.68 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 124.866 1.354 . . . . 76.45 111.398 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -51.85 -55.82 17.74 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.254 1.205 . . . . 93.85 114.254 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -43.39 82.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 113.635 0.976 . . . . 84.02 113.635 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -56.27 -46.5 79.67 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 123.16 0.288 . . . . 95.28 111.518 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.31 -43.54 93.69 Favored Glycine 0 N--CA 1.443 -0.883 0 O-C-N 123.978 0.799 . . . . 83.83 112.171 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -67.68 -45.76 74.28 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 113.539 0.94 . . . . 102.31 113.539 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 11.5 mt -57.84 -40.28 75.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.348 -0.842 . . . . 92.27 109.583 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.15 -49.74 73.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.723 0.64 . . . . 103.76 111.644 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.69 -31.58 71.64 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.687 0.995 . . . . 106.14 113.687 175.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.24 -50.49 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 119.329 -0.367 . . . . 108.59 110.494 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 ttmt . . . . . 0 N--CA 1.469 0.523 0 O-C-N 123.535 0.522 . . . . 108.88 111.576 176.949 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . 0.72 ' CB ' ' CA ' ' A' ' 7' ' ' ALA 1.634 . . . . . . . 0 N--CA 1.505 2.313 0 N-CA-C 115.575 1.695 . . . . 101.91 115.575 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.46 27.52 3.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.499 0.926 . . . . 104.9 113.499 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -64.93 -24.33 67.49 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.107 0.78 . . . . 106.93 113.107 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.92 -29.98 44.83 Favored Glycine 0 N--CA 1.474 1.167 0 N-CA-C 115.573 0.989 . . . . 100.26 115.573 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.1 m -78.38 -24.7 46.24 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.999 0.428 . . . . 94.82 111.586 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.95 -39.33 0.83 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.911 1.284 . . . . 95.46 113.855 176.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -68.55 -37.93 80.34 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.276 0.36 . . . . 126.52 111.717 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -79.51 -43.9 9.94 Favored Glycine 0 N--CA 1.47 0.949 0 CA-C-O 121.337 0.41 . . . . 97.31 113.673 -177.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 30.8 mtm -50.31 -39.99 47.31 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.799 1.407 . . . . 81.15 114.799 166.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.94 -46.29 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 117.935 0.334 . . . . 70.74 111.836 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.0 mt -59.43 -35.18 73.52 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.426 0.528 . . . . 79.18 112.426 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -58.89 -49.35 78.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.026 -0.534 . . . . 91.44 112.173 172.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.1 tpt85 -59.55 -51.75 68.51 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.862 0.69 . . . . 85.11 112.862 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 36.0 mt -55.57 -21.21 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 N-CA-C 112.679 0.622 . . . . 82.9 112.679 174.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.7 p -74.91 -21.27 59.31 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 115.184 1.549 . . . . 95.38 115.184 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.9 73.13 0.8 Allowed 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.358 0.411 . . . . 109.34 109.936 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.7 142.46 12.64 Favored Glycine 0 N--CA 1.473 1.123 0 N-CA-C 117.51 1.764 . . . . 96.02 117.51 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -50.28 138.77 16.04 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.837 0.855 . . . . 88.31 110.382 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.0 t -158.35 175.24 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.108 0.781 . . . . 75.63 113.108 -172.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -144.64 149.97 36.59 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.501 0.72 . . . . 83.61 109.812 -166.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -32.05 -56.59 0.4 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 118.241 2.056 . . . . 63.33 118.241 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -56.51 -51.18 69.5 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 114.252 1.204 . . . . 91.77 114.252 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.78 -43.29 90.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 109.927 -0.397 . . . . 88.81 109.927 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.5 mt -56.36 -53.44 40.1 Favored 'Isoleucine or valine' 0 C--O 1.25 1.09 0 O-C-N 124.382 1.051 . . . . 71.3 111.177 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.9 m -62.44 -36.62 82.98 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 124.412 1.07 . . . . 70.79 111.906 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -69.34 -44.43 71.65 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.023 -0.732 . . . . 78.63 109.023 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.4 -42.12 77.41 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 109.062 -0.718 . . . . 84.01 109.062 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.4 mt -58.83 -48.06 82.66 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 114.156 1.169 . . . . 79.57 114.156 174.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -56.93 -37.62 71.74 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.165 0.915 . . . . 97.08 111.757 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -70.48 -32.94 70.66 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.983 1.475 . . . . 96.12 114.983 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . . . -62.92 -35.29 79.6 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.195 0.443 . . . . 91.83 112.195 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 137.84 -30.57 2.56 Favored Glycine 0 N--CA 1.473 1.124 0 N-CA-C 120.463 2.945 . . . . 96.21 120.463 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.41 86.45 3.79 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.165 0.983 . . . . 107.21 110.776 178.096 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.19 9.76 19.07 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.412 -1.267 . . . . 116.38 110.616 -178.501 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -74.96 -18.91 60.31 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 114.455 -1.248 . . . . 110.08 110.135 166.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.29 152.79 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 114.024 1.12 . . . . 96.76 114.024 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.13 139.72 48.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.492 0 N-CA-C 106.987 -1.486 . . . . 93.37 106.987 177.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -42.24 -45.47 4.15 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 118.921 -0.562 . . . . 90.77 111.928 175.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.03 -62.79 5.9 Favored Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.049 0.833 . . . . 84.53 114.176 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -31.81 -36.07 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 116.029 1.863 . . . . 88.01 116.029 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.07 -45.78 41.43 Favored 'Isoleucine or valine' 0 C--O 1.249 1.069 0 CA-C-N 117.988 0.358 . . . . 78.45 111.032 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -59.91 -39.25 84.77 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 114.38 1.252 . . . . 84.08 114.38 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.36 -41.8 97.67 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.646 0.591 . . . . 90.0 111.434 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.7 mt -63.94 -51.86 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.788 -0.642 . . . . 77.01 109.589 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.6 mt -44.37 -57.13 3.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.782 0.29 . . . . 68.69 111.782 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.3 t -50.85 -49.23 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 122.924 0.49 . . . . 76.84 111.405 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -56.83 -44.8 82.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.924 0.713 . . . . 95.29 112.924 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.7 -38.28 89.78 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.483 1.29 . . . . 75.03 114.483 178.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -59.5 -46.18 89.57 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.079 0.4 . . . . 79.03 112.079 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -72.12 -29.07 63.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.784 0.833 . . . . 96.52 111.988 -176.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -77.94 -17.12 57.59 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.734 -0.839 . . . . 94.98 108.734 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.28 23.73 50.31 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 115.092 0.797 . . . . 80.36 115.092 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mt -97.4 -8.99 28.19 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 114.082 1.141 . . . . 80.46 114.082 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.15 154.91 40.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 121.558 -0.714 . . . . 68.91 112.389 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' A' ' 77' ' ' THR . 65.5 mt-10 -110.62 140.49 44.9 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.76 -0.655 . . . . 76.77 112.102 177.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.8 mm -102.76 121.54 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 O-C-N 124.268 0.98 . . . . 70.14 112.459 -175.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -110.06 102.09 10.84 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 106.552 -1.647 . . . . 71.73 106.552 157.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt -76.59 123.0 25.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.566 -0.902 . . . . 89.78 108.566 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -117.77 128.19 54.63 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 123.256 0.348 . . . . 82.41 110.501 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -89.17 158.91 17.73 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.676 0.991 . . . . 101.54 113.676 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.7 p -142.71 151.07 40.93 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.648 0.737 . . . . 94.6 112.674 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.52 -4.44 59.17 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.367 -0.833 . . . . 81.15 108.793 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . . . -88.27 -38.85 14.88 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.871 0.693 . . . . 89.26 112.871 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.48 -159.45 10.67 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 123.676 0.655 . . . . 83.78 114.034 173.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -60.73 158.81 31.18 Favored 'Trans proline' 0 C--O 1.254 1.285 0 C-N-CA 124.39 3.393 . . . . 81.21 112.965 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -75.06 154.38 42.18 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 115.047 -2.835 . . . . 75.86 111.601 176.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -120.84 134.39 55.29 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 105.754 -1.943 . . . . 73.29 105.754 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -79.12 126.13 30.33 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.479 -0.934 . . . . 74.33 108.479 170.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -90.41 135.3 33.77 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.601 -0.84 . . . . 72.77 111.638 166.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -108.45 135.44 49.72 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 114.679 -1.146 . . . . 87.85 112.039 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . 0.401 ' O ' ' N ' ' A' ' 61' ' ' GLU . 1.8 t -137.53 164.66 28.19 Favored 'General case' 0 CA--C 1.562 1.441 0 N-CA-C 106.764 -1.569 . . . . 81.39 106.764 169.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.38 134.6 36.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 115.021 1.489 . . . . 67.61 115.021 -179.247 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.2 p -70.58 163.44 63.52 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 115.475 -0.784 . . . . 66.34 109.718 164.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -53.62 -42.4 66.25 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 117.502 -1.199 . . . . 71.28 112.993 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.55 -40.79 72.36 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.342 1.238 . . . . 67.59 114.342 174.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.53 -45.46 89.72 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 112.033 -0.427 . . . . 64.67 112.033 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -43.75 -54.82 4.85 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.559 0.744 . . . . 81.11 111.335 164.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . . . -58.82 -51.76 68.64 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.951 0.723 . . . . 75.62 112.951 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -58.43 -35.14 71.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 114.703 1.372 . . . . 84.36 114.703 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.7 tp -71.78 -41.1 68.76 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.03 0.443 . . . . 67.42 111.684 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.39 -44.56 84.62 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 114.817 -1.083 . . . . 71.5 111.557 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 8.2 mt -56.58 -49.45 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.831 0.452 . . . . 85.83 111.601 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -54.8 -51.36 66.05 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.92 1.288 . . . . 76.86 112.426 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 30.6 m95 -58.12 -46.81 84.94 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.55 0.945 . . . . 74.01 113.55 177.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -53.11 -42.01 65.57 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.635 1.174 . . . . 81.43 111.276 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.23 -45.33 88.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.701 1.0 . . . . 93.75 113.701 173.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -59.24 -49.88 76.14 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 119.851 -0.739 . . . . 89.39 111.62 173.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -48.6 -49.96 34.63 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 123.867 0.73 . . . . 84.89 111.907 172.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.17 -51.43 66.54 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 113.296 0.85 . . . . 104.88 113.296 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.3 tp -77.59 -32.04 18.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 N-CA-C 114.052 1.131 . . . . 90.59 114.052 -174.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -64.1 -47.24 80.81 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.926 -0.768 . . . . 88.87 108.926 173.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -56.58 -45.67 89.7 Favored Glycine 0 C--N 1.331 0.286 0 N-CA-C 115.343 0.897 . . . . 79.15 115.343 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -71.6 -46.22 59.87 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 112.371 0.508 . . . . 130.99 112.371 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mm -53.24 -47.42 56.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.768 0.667 . . . . 95.36 110.454 174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 ttm -70.83 -30.34 66.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.068 0.855 . . . . 120.58 111.838 -176.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.24 -46.25 84.59 Favored 'General case' 0 N--CA 1.461 0.117 0 O-C-N 123.873 0.733 . . . . 113.93 111.025 172.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 61.8 t -52.49 -55.6 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.258 0.349 . . . . 100.24 110.323 170.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.5 tttm . . . . . 0 N--CA 1.471 0.597 0 C-N-CA 125.528 1.531 . . . . 89.43 114.685 -176.671 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 113.347 0.869 . . . . 115.08 113.347 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . 0.356 0.0 OUTLIER -153.18 31.04 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 120.148 3.388 . . . . 106.85 120.148 -178.87 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -52.44 -27.65 16.84 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 113.221 0.823 . . . . 94.42 113.221 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.43 -44.92 97.11 Favored Glycine 0 N--CA 1.476 1.321 0 N-CA-C 114.191 0.437 . . . . 91.65 114.191 173.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 21.5 m -67.4 -26.3 66.37 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.125 1.528 . . . . 92.38 115.125 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 tp -46.24 -44.14 16.05 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.067 1.506 . . . . 99.24 115.067 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -60.56 -33.6 72.93 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.248 0.462 . . . . 133.4 112.248 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.81 -30.17 8.16 Favored Glycine 0 N--CA 1.477 1.394 0 N-CA-C 115.837 1.095 . . . . 97.85 115.837 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' MET . . . . . 0.444 ' SD ' HG11 ' A' ' 103' ' ' VAL . 6.2 mmt -53.41 -41.58 66.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.044 0.938 . . . . 95.6 113.23 164.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ILE . . . . . 0.973 HG12 HD11 ' B' ' 30' ' ' ILE . 58.0 mt -67.2 -47.04 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 123.435 0.694 . . . . 72.41 112.368 177.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.6 mt -61.44 -31.93 71.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.535 0.734 . . . . 70.78 111.742 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.37 -47.42 85.48 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 112.833 0.679 . . . . 87.88 112.833 170.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -65.85 -42.26 90.69 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.938 0.348 . . . . 82.09 111.938 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.54 -21.71 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 111.885 0.328 . . . . 73.69 111.885 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 82.8 p -73.23 -11.64 60.58 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 115.369 1.618 . . . . 83.24 115.369 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.99 44.44 2.32 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 114.176 1.176 . . . . 100.91 114.176 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.44 146.62 7.28 Favored Glycine 0 N--CA 1.476 1.348 0 N-CA-C 116.713 1.445 . . . . 85.13 116.713 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -47.56 128.06 12.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.724 0.809 . . . . 91.76 109.414 171.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -144.98 175.95 9.84 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.798 -0.637 . . . . 75.86 112.271 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -143.86 152.11 40.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 109.432 -0.581 . . . . 84.12 109.432 -170.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . 0.446 ' HA3' ' CZ ' ' B' ' 48' ' ' TYR . . . -34.85 -49.01 0.75 Allowed Glycine 0 N--CA 1.466 0.642 0 N-CA-C 116.602 1.401 . . . . 69.57 116.602 -174.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -61.98 -53.91 49.03 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 114.333 1.234 . . . . 78.9 114.333 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.68 -43.6 93.95 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.356 0.41 . . . . 84.31 111.058 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 16' ' ' ILE 0.481 0.0 OUTLIER -63.4 -42.33 95.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 N-CA-C 113.731 1.012 . . . . 72.98 113.731 174.075 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 5.4 m -61.36 -43.24 99.21 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.787 0.662 . . . . 76.7 112.787 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -61.85 -42.35 98.94 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.442 -0.345 . . . . 91.49 111.711 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' TYR . . . . . 0.499 ' OH ' HG13 ' A' ' 103' ' ' VAL . 28.9 t80 -62.02 -39.9 93.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.413 0.523 . . . . 94.4 112.413 179.172 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -66.4 -36.42 82.79 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.849 0.718 . . . . 96.19 112.863 174.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -67.77 -40.89 83.99 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.425 1.09 . . . . 105.68 111.435 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.93 -35.32 80.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.942 1.09 . . . . 91.77 113.942 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 48.7 mt -67.05 -10.44 49.91 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 114.125 1.157 . . . . 102.82 114.125 175.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 115.19 -12.11 19.63 Favored Glycine 0 C--N 1.335 0.506 0 O-C-N 123.407 0.442 . . . . 98.42 113.774 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -88.52 76.15 8.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.223 0.535 . . . . 113.35 110.556 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.88 -15.14 39.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.42 1.637 . . . . 108.79 115.42 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 pm0 -55.4 -27.55 48.36 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.204 1.928 . . . . 109.09 116.204 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 2.0 pp -88.19 146.59 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 114.418 1.266 . . . . 99.16 114.418 -175.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 11.4 t -109.23 155.06 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.689 -0.856 . . . . 92.07 108.689 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -33.1 -50.02 0.27 Allowed 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.866 0.691 . . . . 90.76 112.866 172.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.5 -52.4 50.39 Favored Glycine 0 C--N 1.336 0.528 0 N-CA-C 117.275 1.67 . . . . 84.84 117.275 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' THR . . . . . 0.418 ' HA ' HG22 ' B' ' 49' ' ' THR . 4.2 m -43.81 -37.65 2.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.831 1.252 . . . . 86.24 113.971 168.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.45 -51.34 25.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 122.528 0.331 . . . . 79.77 110.724 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' TYR . . . . . 0.446 ' CZ ' ' HA3' ' B' ' 27' ' ' GLY . 82.3 m-85 -57.81 -35.02 70.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.594 0.59 . . . . 85.07 112.594 176.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . 0.418 HG22 ' HA ' ' B' ' 46' ' ' THR . 6.4 t -75.42 -14.62 60.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.381 0.511 . . . . 100.47 112.381 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 49.5 mt -93.26 -35.89 6.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 115.839 -0.618 . . . . 81.6 109.587 167.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.09 -33.35 73.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.969 0.729 . . . . 72.26 112.969 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 7.5 t -70.54 -49.65 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.287 -1.375 . . . . 83.26 107.287 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 22.4 ttm180 -50.38 -50.02 52.75 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.294 -0.866 . . . . 103.08 111.186 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -23.64 65.9 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.732 1.752 . . . . 79.55 115.732 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -80.08 -45.41 18.31 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.817 -0.438 . . . . 106.71 109.817 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -51.49 -47.6 63.17 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 124.198 0.936 . . . . 99.72 110.381 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -76.96 -10.41 59.34 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.44 1.096 . . . . 100.3 111.096 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.66 18.35 61.97 Favored Glycine 0 C--O 1.242 0.656 0 N-CA-C 118.436 2.134 . . . . 72.42 118.436 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mt -95.45 -2.25 49.18 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.569 1.322 . . . . 68.91 114.569 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.3 m -129.83 152.23 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.454 0.539 . . . . 69.92 112.454 175.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . 0.403 ' HB2' HG22 ' B' ' 77' ' ' THR . 38.0 mt-10 -109.82 153.68 24.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.255 -0.43 . . . . 90.69 110.14 173.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 44.8 mm -121.15 117.2 52.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 115.838 -0.619 . . . . 75.22 112.447 -167.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.99 100.35 9.71 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 106.605 -1.628 . . . . 93.96 106.605 164.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -73.34 124.91 26.66 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.615 -0.883 . . . . 81.71 108.615 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . . . -118.07 123.98 46.97 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 116.495 -0.32 . . . . 68.61 110.163 -174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . . . -85.48 161.25 19.46 Favored 'General case' 0 CA--C 1.561 1.371 0 N-CA-C 114.624 1.342 . . . . 70.61 114.624 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.3 t -146.2 138.33 25.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.674 1.189 . . . . 74.57 109.849 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.93 -9.52 55.45 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.489 -0.93 . . . . 86.32 108.489 166.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . . . -92.87 -32.27 14.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.269 0.628 . . . . 96.08 112.573 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -153.11 -160.04 9.45 Favored Glycine 0 N--CA 1.487 2.049 0 C-N-CA 124.405 1.002 . . . . 88.84 114.9 169.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -75.26 167.64 26.36 Favored 'Trans proline' 0 C--N 1.364 1.391 0 C-N-CA 124.677 3.585 . . . . 90.03 111.893 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -77.13 133.21 13.3 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 117.127 -1.448 . . . . 78.21 114.298 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . . . -102.06 148.11 25.77 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 107.48 -1.304 . . . . 71.97 107.48 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -95.88 136.81 35.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.152 0.581 . . . . 69.2 111.33 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -110.88 131.81 54.73 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.952 -0.299 . . . . 71.78 111.032 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.48 139.23 42.31 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 115.736 1.754 . . . . 76.9 115.736 -166.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' THR . . . . . 0.403 HG22 ' HB2' ' B' ' 61' ' ' GLU . 0.9 OUTLIER -137.55 148.67 46.13 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.83 -1.532 . . . . 65.28 107.942 -177.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.64 133.62 45.81 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 119.783 -0.767 . . . . 63.83 111.149 173.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 21.9 p -80.6 167.7 30.81 Favored Pre-proline 0 C--O 1.237 0.432 0 N-CA-C 107.6 -1.259 . . . . 66.73 107.6 169.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.57 -34.08 96.79 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 114.457 -3.229 . . . . 76.37 113.202 173.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.25 96.39 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.43 0.456 . . . . 70.31 111.858 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.38 -38.43 58.3 Favored Glycine 0 N--CA 1.469 0.856 0 CA-C-N 115.647 -0.706 . . . . 66.34 112.726 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -51.75 -50.25 60.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.707 0.403 . . . . 94.96 109.983 166.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -61.97 -48.05 82.09 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.206 1.928 . . . . 77.74 116.206 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLU . . . . . 0.545 ' HA ' HD12 ' B' ' 88' ' ' ILE . 0.7 OUTLIER -65.22 -40.5 94.19 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 117.947 0.339 . . . . 90.86 111.887 -176.003 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.65 -45.06 90.15 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.38 0.272 . . . . 66.51 111.507 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -51.13 -43.64 61.22 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 118.864 -0.589 . . . . 68.52 111.173 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' B' ' 85' ' ' GLU . 5.5 mt -67.93 -50.72 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-N 118.067 0.394 . . . . 77.08 111.845 179.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -43.49 -50.81 6.99 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.133 0.973 . . . . 74.09 113.014 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -62.95 -45.01 94.5 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.644 1.349 . . . . 72.05 114.644 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . . . -57.28 -37.63 72.7 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.518 0.727 . . . . 77.82 111.783 171.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . . . -62.32 -41.65 98.73 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.166 0.432 . . . . 71.82 112.166 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -65.51 -51.36 60.57 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.156 0.799 . . . . 77.69 113.156 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -48.43 -47.96 37.68 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 124.866 1.354 . . . . 76.45 111.398 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -51.85 -55.82 17.74 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.254 1.205 . . . . 93.85 114.254 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -43.39 82.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 113.635 0.976 . . . . 84.02 113.635 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -56.27 -46.5 79.67 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 123.16 0.288 . . . . 95.28 111.518 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.31 -43.54 93.69 Favored Glycine 0 N--CA 1.443 -0.883 0 O-C-N 123.978 0.799 . . . . 83.83 112.171 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LYS . . . . . 0.539 ' HE2' ' HA ' ' B' ' 99' ' ' LYS . 4.4 mmpt? -67.68 -45.76 74.28 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 113.539 0.94 . . . . 102.31 113.539 179.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 11.5 mt -57.84 -40.28 75.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.348 -0.842 . . . . 92.27 109.583 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.15 -49.74 73.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.723 0.64 . . . . 103.76 111.644 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.69 -31.58 71.64 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.687 0.995 . . . . 106.14 113.687 175.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.24 -50.49 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 119.329 -0.367 . . . . 108.59 110.494 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 ttmt . . . . . 0 N--CA 1.469 0.523 0 O-C-N 123.535 0.522 . . . . 108.88 111.576 176.949 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . 0.72 ' CB ' ' CA ' ' A' ' 7' ' ' ALA 1.634 . . . . . . . 0 N--CA 1.505 2.313 0 N-CA-C 115.575 1.695 . . . . 101.91 115.575 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.46 27.52 3.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.499 0.926 . . . . 104.9 113.499 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -64.93 -24.33 67.49 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.107 0.78 . . . . 106.93 113.107 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.92 -29.98 44.83 Favored Glycine 0 N--CA 1.474 1.167 0 N-CA-C 115.573 0.989 . . . . 100.26 115.573 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.1 m -78.38 -24.7 46.24 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.999 0.428 . . . . 94.82 111.586 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.95 -39.33 0.83 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.911 1.284 . . . . 95.46 113.855 176.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -68.55 -37.93 80.34 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.276 0.36 . . . . 126.52 111.717 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -79.51 -43.9 9.94 Favored Glycine 0 N--CA 1.47 0.949 0 CA-C-O 121.337 0.41 . . . . 97.31 113.673 -177.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 30.8 mtm -50.31 -39.99 47.31 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.799 1.407 . . . . 81.15 114.799 166.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.94 -46.29 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 117.935 0.334 . . . . 70.74 111.836 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.0 mt -59.43 -35.18 73.52 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.426 0.528 . . . . 79.18 112.426 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -58.89 -49.35 78.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.026 -0.534 . . . . 91.44 112.173 172.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.1 tpt85 -59.55 -51.75 68.51 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.862 0.69 . . . . 85.11 112.862 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . 0.632 HG22 HD22 ' A' ' 78' ' ' LEU . 36.0 mt -55.57 -21.21 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 N-CA-C 112.679 0.622 . . . . 82.9 112.679 174.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.7 p -74.91 -21.27 59.31 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 115.184 1.549 . . . . 95.38 115.184 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.9 73.13 0.8 Allowed 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.358 0.411 . . . . 109.34 109.936 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.7 142.46 12.64 Favored Glycine 0 N--CA 1.473 1.123 0 N-CA-C 117.51 1.764 . . . . 96.02 117.51 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -50.28 138.77 16.04 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.837 0.855 . . . . 88.31 110.382 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.0 t -158.35 175.24 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.108 0.781 . . . . 75.63 113.108 -172.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -144.64 149.97 36.59 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.501 0.72 . . . . 83.61 109.812 -166.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . 0.405 ' HA3' ' CZ ' ' A' ' 48' ' ' TYR . . . -32.05 -56.59 0.4 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 118.241 2.056 . . . . 63.33 118.241 -171.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -56.51 -51.18 69.5 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 114.252 1.204 . . . . 91.77 114.252 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.78 -43.29 90.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 109.927 -0.397 . . . . 88.81 109.927 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.5 mt -56.36 -53.44 40.1 Favored 'Isoleucine or valine' 0 C--O 1.25 1.09 0 O-C-N 124.382 1.051 . . . . 71.3 111.177 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 44' ' ' GLU . 2.9 m -62.44 -36.62 82.98 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 124.412 1.07 . . . . 70.79 111.906 -178.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -69.34 -44.43 71.65 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.023 -0.732 . . . . 78.63 109.023 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.4 -42.12 77.41 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 109.062 -0.718 . . . . 84.01 109.062 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 39' ' ' PHE . 26.4 mt -58.83 -48.06 82.66 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 114.156 1.169 . . . . 79.57 114.156 174.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -56.93 -37.62 71.74 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.165 0.915 . . . . 97.08 111.757 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -70.48 -32.94 70.66 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.983 1.475 . . . . 96.12 114.983 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . . . -62.92 -35.29 79.6 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.195 0.443 . . . . 91.83 112.195 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 137.84 -30.57 2.56 Favored Glycine 0 N--CA 1.473 1.124 0 N-CA-C 120.463 2.945 . . . . 96.21 120.463 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PHE . . . . . 0.424 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -77.41 86.45 3.79 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.165 0.983 . . . . 107.21 110.776 178.096 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.19 9.76 19.07 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.412 -1.267 . . . . 116.38 110.616 -178.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -74.96 -18.91 60.31 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 114.455 -1.248 . . . . 110.08 110.135 166.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.29 152.79 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 114.024 1.12 . . . . 96.76 114.024 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.13 139.72 48.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.492 0 N-CA-C 106.987 -1.486 . . . . 93.37 106.987 177.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . 0.425 ' HA ' HG21 ' A' ' 31' ' ' THR . 35.5 mt-10 -42.24 -45.47 4.15 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 118.921 -0.562 . . . . 90.77 111.928 175.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.03 -62.79 5.9 Favored Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.049 0.833 . . . . 84.53 114.176 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -31.81 -36.07 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 116.029 1.863 . . . . 88.01 116.029 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.07 -45.78 41.43 Favored 'Isoleucine or valine' 0 C--O 1.249 1.069 0 CA-C-N 117.988 0.358 . . . . 78.45 111.032 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . 0.405 ' CZ ' ' HA3' ' A' ' 27' ' ' GLY . 43.6 m-85 -59.91 -39.25 84.77 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 114.38 1.252 . . . . 84.08 114.38 -177.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.36 -41.8 97.67 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.646 0.591 . . . . 90.0 111.434 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.7 mt -63.94 -51.86 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.788 -0.642 . . . . 77.01 109.589 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.6 mt -44.37 -57.13 3.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.782 0.29 . . . . 68.69 111.782 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.3 t -50.85 -49.23 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 122.924 0.49 . . . . 76.84 111.405 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -56.83 -44.8 82.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.924 0.713 . . . . 95.29 112.924 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.7 -38.28 89.78 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.483 1.29 . . . . 75.03 114.483 178.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -59.5 -46.18 89.57 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.079 0.4 . . . . 79.03 112.079 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -72.12 -29.07 63.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.784 0.833 . . . . 96.52 111.988 -176.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -77.94 -17.12 57.59 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.734 -0.839 . . . . 94.98 108.734 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.28 23.73 50.31 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 115.092 0.797 . . . . 80.36 115.092 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mt -97.4 -8.99 28.19 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 114.082 1.141 . . . . 80.46 114.082 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.15 154.91 40.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 121.558 -0.714 . . . . 68.91 112.389 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -110.62 140.49 44.9 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.76 -0.655 . . . . 76.77 112.102 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.8 mm -102.76 121.54 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 O-C-N 124.268 0.98 . . . . 70.14 112.459 -175.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -110.06 102.09 10.84 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 106.552 -1.647 . . . . 71.73 106.552 157.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt -76.59 123.0 25.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.566 -0.902 . . . . 89.78 108.566 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -117.77 128.19 54.63 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 123.256 0.348 . . . . 82.41 110.501 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -89.17 158.91 17.73 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.676 0.991 . . . . 101.54 113.676 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.7 p -142.71 151.07 40.93 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.648 0.737 . . . . 94.6 112.674 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.52 -4.44 59.17 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.367 -0.833 . . . . 81.15 108.793 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . . . -88.27 -38.85 14.88 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.871 0.693 . . . . 89.26 112.871 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.48 -159.45 10.67 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 123.676 0.655 . . . . 83.78 114.034 173.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -60.73 158.81 31.18 Favored 'Trans proline' 0 C--O 1.254 1.285 0 C-N-CA 124.39 3.393 . . . . 81.21 112.965 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -75.06 154.38 42.18 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 115.047 -2.835 . . . . 75.86 111.601 176.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -120.84 134.39 55.29 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 105.754 -1.943 . . . . 73.29 105.754 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -79.12 126.13 30.33 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.479 -0.934 . . . . 74.33 108.479 170.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -90.41 135.3 33.77 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.601 -0.84 . . . . 72.77 111.638 166.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -108.45 135.44 49.72 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 114.679 -1.146 . . . . 87.85 112.039 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 t -137.53 164.66 28.19 Favored 'General case' 0 CA--C 1.562 1.441 0 N-CA-C 106.764 -1.569 . . . . 81.39 106.764 169.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.632 HD22 HG22 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -80.38 134.6 36.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 115.021 1.489 . . . . 67.61 115.021 -179.247 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.2 p -70.58 163.44 63.52 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 115.475 -0.784 . . . . 66.34 109.718 164.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -53.62 -42.4 66.25 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 117.502 -1.199 . . . . 71.28 112.993 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.55 -40.79 72.36 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.342 1.238 . . . . 67.59 114.342 174.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.53 -45.46 89.72 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 112.033 -0.427 . . . . 64.67 112.033 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -43.75 -54.82 4.85 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.559 0.744 . . . . 81.11 111.335 164.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . . . -58.82 -51.76 68.64 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.951 0.723 . . . . 75.62 112.951 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -58.43 -35.14 71.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 114.703 1.372 . . . . 84.36 114.703 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.7 tp -71.78 -41.1 68.76 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.03 0.443 . . . . 67.42 111.684 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.39 -44.56 84.62 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 114.817 -1.083 . . . . 71.5 111.557 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 8.2 mt -56.58 -49.45 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.831 0.452 . . . . 85.83 111.601 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -54.8 -51.36 66.05 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.92 1.288 . . . . 76.86 112.426 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 30.6 m95 -58.12 -46.81 84.94 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.55 0.945 . . . . 74.01 113.55 177.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -53.11 -42.01 65.57 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.635 1.174 . . . . 81.43 111.276 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.23 -45.33 88.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.701 1.0 . . . . 93.75 113.701 173.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TRP . . . . . 0.427 ' HE3' ' HG3' ' A' ' 97' ' ' GLN . 17.2 m95 -59.24 -49.88 76.14 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 119.851 -0.739 . . . . 89.39 111.62 173.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -48.6 -49.96 34.63 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 123.867 0.73 . . . . 84.89 111.907 172.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.17 -51.43 66.54 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 113.296 0.85 . . . . 104.88 113.296 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . 0.451 ' O ' HG12 ' A' ' 100' ' ' ILE . 1.3 tp -77.59 -32.04 18.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 N-CA-C 114.052 1.131 . . . . 90.59 114.052 -174.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HG3' ' HE3' ' A' ' 93' ' ' TRP . 36.9 mt-30 -64.1 -47.24 80.81 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.926 -0.768 . . . . 88.87 108.926 173.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -56.58 -45.67 89.7 Favored Glycine 0 C--N 1.331 0.286 0 N-CA-C 115.343 0.897 . . . . 79.15 115.343 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -71.6 -46.22 59.87 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 112.371 0.508 . . . . 130.99 112.371 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 96' ' ' ILE . 5.1 mm -53.24 -47.42 56.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.768 0.667 . . . . 95.36 110.454 174.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 ttm -70.83 -30.34 66.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.068 0.855 . . . . 120.58 111.838 -176.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.24 -46.25 84.59 Favored 'General case' 0 N--CA 1.461 0.117 0 O-C-N 123.873 0.733 . . . . 113.93 111.025 172.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . 0.499 HG13 ' OH ' ' B' ' 33' ' ' TYR . 61.8 t -52.49 -55.6 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.258 0.349 . . . . 100.24 110.323 170.347 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.5 tttm . . . . . 0 N--CA 1.471 0.597 0 C-N-CA 125.528 1.531 . . . . 89.43 114.685 -176.671 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 113.347 0.869 . . . . 115.08 113.347 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . 0.356 0.0 OUTLIER -153.18 31.04 0.48 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 120.148 3.388 . . . . 106.85 120.148 -178.87 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -52.44 -27.65 16.84 Favored 'General case' 0 CA--C 1.555 1.159 0 N-CA-C 113.221 0.823 . . . . 94.42 113.221 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -60.43 -44.92 97.11 Favored Glycine 0 N--CA 1.476 1.321 0 N-CA-C 114.191 0.437 . . . . 91.65 114.191 173.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 21.5 m -67.4 -26.3 66.37 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 115.125 1.528 . . . . 92.38 115.125 176.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 tp -46.24 -44.14 16.05 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 115.067 1.506 . . . . 99.24 115.067 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -60.56 -33.6 72.93 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.248 0.462 . . . . 133.4 112.248 177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.81 -30.17 8.16 Favored Glycine 0 N--CA 1.477 1.394 0 N-CA-C 115.837 1.095 . . . . 97.85 115.837 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' MET . . . . . 0.444 ' SD ' HG11 ' A' ' 103' ' ' VAL . 6.2 mmt -53.41 -41.58 66.13 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.044 0.938 . . . . 95.6 113.23 164.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ILE . . . . . 0.973 HG12 HD11 ' B' ' 30' ' ' ILE . 58.0 mt -67.2 -47.04 82.8 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 123.435 0.694 . . . . 72.41 112.368 177.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.6 mt -61.44 -31.93 71.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.535 0.734 . . . . 70.78 111.742 175.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -59.37 -47.42 85.48 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 112.833 0.679 . . . . 87.88 112.833 170.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ARG . . . . . . . . . . . . . 41.0 tpt85 -65.85 -42.26 90.69 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.938 0.348 . . . . 82.09 111.938 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.54 -21.71 28.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 111.885 0.328 . . . . 73.69 111.885 178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' SER . . . . . . . . . . . . . 82.8 p -73.23 -11.64 60.58 Favored 'General case' 0 C--O 1.246 0.898 0 N-CA-C 115.369 1.618 . . . . 83.24 115.369 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.99 44.44 2.32 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 114.176 1.176 . . . . 100.91 114.176 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 122.44 146.62 7.28 Favored Glycine 0 N--CA 1.476 1.348 0 N-CA-C 116.713 1.445 . . . . 85.13 116.713 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -47.56 128.06 12.12 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.724 0.809 . . . . 91.76 109.414 171.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 9.0 t -144.98 175.95 9.84 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 115.798 -0.637 . . . . 75.86 112.271 -177.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 12.7 p90 -143.86 152.11 40.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 109.432 -0.581 . . . . 84.12 109.432 -170.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . 0.446 ' HA3' ' CZ ' ' B' ' 48' ' ' TYR . . . -34.85 -49.01 0.75 Allowed Glycine 0 N--CA 1.466 0.642 0 N-CA-C 116.602 1.401 . . . . 69.57 116.602 -174.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -61.98 -53.91 49.03 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 114.333 1.234 . . . . 78.9 114.333 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -59.68 -43.6 93.95 Favored 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.356 0.41 . . . . 84.31 111.058 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.973 HD11 HG12 ' B' ' 16' ' ' ILE 0.481 0.0 OUTLIER -63.4 -42.33 95.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.83 0 N-CA-C 113.731 1.012 . . . . 72.98 113.731 174.075 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 5.4 m -61.36 -43.24 99.21 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.787 0.662 . . . . 76.7 112.787 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -61.85 -42.35 98.94 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.442 -0.345 . . . . 91.49 111.711 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.499 ' OH ' HG13 ' A' ' 103' ' ' VAL . 28.9 t80 -62.02 -39.9 93.87 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.413 0.523 . . . . 94.4 112.413 179.172 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mp -66.4 -36.42 82.79 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.849 0.718 . . . . 96.19 112.863 174.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -67.77 -40.89 83.99 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.425 1.09 . . . . 105.68 111.435 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.93 -35.32 80.29 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.942 1.09 . . . . 91.77 113.942 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 48.7 mt -67.05 -10.44 49.91 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 114.125 1.157 . . . . 102.82 114.125 175.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 115.19 -12.11 19.63 Favored Glycine 0 C--N 1.335 0.506 0 O-C-N 123.407 0.442 . . . . 98.42 113.774 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -88.52 76.15 8.24 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.223 0.535 . . . . 113.35 110.556 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.88 -15.14 39.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.42 1.637 . . . . 108.79 115.42 -174.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 18.5 pm0 -55.4 -27.55 48.36 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 116.204 1.928 . . . . 109.09 116.204 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 2.0 pp -88.19 146.59 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 N-CA-C 114.418 1.266 . . . . 99.16 114.418 -175.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 11.4 t -109.23 155.06 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 108.689 -0.856 . . . . 92.07 108.689 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -33.1 -50.02 0.27 Allowed 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.866 0.691 . . . . 90.76 112.866 172.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -56.5 -52.4 50.39 Favored Glycine 0 C--N 1.336 0.528 0 N-CA-C 117.275 1.67 . . . . 84.84 117.275 -173.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' THR . . . . . 0.418 ' HA ' HG22 ' B' ' 49' ' ' THR . 4.2 m -43.81 -37.65 2.87 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.831 1.252 . . . . 86.24 113.971 168.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 34.6 t -73.45 -51.34 25.82 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 122.528 0.331 . . . . 79.77 110.724 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' TYR . . . . . 0.446 ' CZ ' ' HA3' ' B' ' 27' ' ' GLY . 82.3 m-85 -57.81 -35.02 70.28 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.594 0.59 . . . . 85.07 112.594 176.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . 0.418 HG22 ' HA ' ' B' ' 46' ' ' THR . 6.4 t -75.42 -14.62 60.46 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.381 0.511 . . . . 100.47 112.381 -179.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 49.5 mt -93.26 -35.89 6.95 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 115.839 -0.618 . . . . 81.6 109.587 167.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 55.5 mt -61.09 -33.35 73.21 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.969 0.729 . . . . 72.26 112.969 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 7.5 t -70.54 -49.65 51.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.287 -1.375 . . . . 83.26 107.287 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . . . . . . . . . 22.4 ttm180 -50.38 -50.02 52.75 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.294 -0.866 . . . . 103.08 111.186 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -23.64 65.9 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 115.732 1.752 . . . . 79.55 115.732 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -80.08 -45.41 18.31 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.817 -0.438 . . . . 106.71 109.817 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -51.49 -47.6 63.17 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 124.198 0.936 . . . . 99.72 110.381 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 60.6 mttm -76.96 -10.41 59.34 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 124.44 1.096 . . . . 100.3 111.096 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.66 18.35 61.97 Favored Glycine 0 C--O 1.242 0.656 0 N-CA-C 118.436 2.134 . . . . 72.42 118.436 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.6 mt -95.45 -2.25 49.18 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 114.569 1.322 . . . . 68.91 114.569 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 5.3 m -129.83 152.23 37.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 112.454 0.539 . . . . 69.92 112.454 175.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.403 ' HB2' HG22 ' B' ' 77' ' ' THR . 38.0 mt-10 -109.82 153.68 24.07 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.255 -0.43 . . . . 90.69 110.14 173.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 44.8 mm -121.15 117.2 52.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 115.838 -0.619 . . . . 75.22 112.447 -167.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.99 100.35 9.71 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 106.605 -1.628 . . . . 93.96 106.605 164.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 5.6 ttpp -73.34 124.91 26.66 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.615 -0.883 . . . . 81.71 108.615 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . . . -118.07 123.98 46.97 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 116.495 -0.32 . . . . 68.61 110.163 -174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . . . -85.48 161.25 19.46 Favored 'General case' 0 CA--C 1.561 1.371 0 N-CA-C 114.624 1.342 . . . . 70.61 114.624 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.3 t -146.2 138.33 25.12 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.674 1.189 . . . . 74.57 109.849 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.93 -9.52 55.45 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.489 -0.93 . . . . 86.32 108.489 166.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . . . -92.87 -32.27 14.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.269 0.628 . . . . 96.08 112.573 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLY . . . . . . . . . . . . . . . -153.11 -160.04 9.45 Favored Glycine 0 N--CA 1.487 2.049 0 C-N-CA 124.405 1.002 . . . . 88.84 114.9 169.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -75.26 167.64 26.36 Favored 'Trans proline' 0 C--N 1.364 1.391 0 C-N-CA 124.677 3.585 . . . . 90.03 111.893 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -77.13 133.21 13.3 Favored 'Trans proline' 0 CA--C 1.547 1.166 0 C-N-CA 117.127 -1.448 . . . . 78.21 114.298 -177.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . . . -102.06 148.11 25.77 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 107.48 -1.304 . . . . 71.97 107.48 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -95.88 136.81 35.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.152 0.581 . . . . 69.2 111.33 173.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -110.88 131.81 54.73 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.952 -0.299 . . . . 71.78 111.032 175.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -107.48 139.23 42.31 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 115.736 1.754 . . . . 76.9 115.736 -166.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' THR . . . . . 0.403 HG22 ' HB2' ' B' ' 61' ' ' GLU . 0.9 OUTLIER -137.55 148.67 46.13 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.83 -1.532 . . . . 65.28 107.942 -177.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.64 133.62 45.81 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 119.783 -0.767 . . . . 63.83 111.149 173.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 21.9 p -80.6 167.7 30.81 Favored Pre-proline 0 C--O 1.237 0.432 0 N-CA-C 107.6 -1.259 . . . . 66.73 107.6 169.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_exo -59.57 -34.08 96.79 Favored 'Trans proline' 0 C--O 1.239 0.562 0 C-N-CA 114.457 -3.229 . . . . 76.37 113.202 173.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.63 -40.25 96.39 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 123.43 0.456 . . . . 70.31 111.858 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLY . . . . . . . . . . . . . . . -72.38 -38.43 58.3 Favored Glycine 0 N--CA 1.469 0.856 0 CA-C-N 115.647 -0.706 . . . . 66.34 112.726 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -51.75 -50.25 60.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.707 0.403 . . . . 94.96 109.983 166.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . . . -61.97 -48.05 82.09 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 116.206 1.928 . . . . 77.74 116.206 172.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLU . . . . . 0.545 ' HA ' HD12 ' B' ' 88' ' ' ILE . 0.7 OUTLIER -65.22 -40.5 94.19 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 117.947 0.339 . . . . 90.86 111.887 -176.003 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.65 -45.06 90.15 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.38 0.272 . . . . 66.51 111.507 171.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -51.13 -43.64 61.22 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 118.864 -0.589 . . . . 68.52 111.173 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' B' ' 85' ' ' GLU . 5.5 mt -67.93 -50.72 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 CA-C-N 118.067 0.394 . . . . 77.08 111.845 179.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -43.49 -50.81 6.99 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.133 0.973 . . . . 74.09 113.014 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -62.95 -45.01 94.5 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.644 1.349 . . . . 72.05 114.644 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . . . -57.28 -37.63 72.7 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.518 0.727 . . . . 77.82 111.783 171.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ARG . . . . . . . . . . . . . . . -62.32 -41.65 98.73 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.166 0.432 . . . . 71.82 112.166 169.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TRP . . . . . . . . . . . . . 3.5 m95 -65.51 -51.36 60.57 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 113.156 0.799 . . . . 77.69 113.156 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -48.43 -47.96 37.68 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 124.866 1.354 . . . . 76.45 111.398 177.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -51.85 -55.82 17.74 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 114.254 1.205 . . . . 93.85 114.254 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -43.39 82.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 113.635 0.976 . . . . 84.02 113.635 -175.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -56.27 -46.5 79.67 Favored 'General case' 0 C--O 1.24 0.554 0 O-C-N 123.16 0.288 . . . . 95.28 111.518 172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLY . . . . . . . . . . . . . . . -57.31 -43.54 93.69 Favored Glycine 0 N--CA 1.443 -0.883 0 O-C-N 123.978 0.799 . . . . 83.83 112.171 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LYS . . . . . 0.539 ' HE2' ' HA ' ' B' ' 99' ' ' LYS . 4.4 mmpt? -67.68 -45.76 74.28 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 113.539 0.94 . . . . 102.31 113.539 179.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ILE . . . . . . . . . . . . . 11.5 mt -57.84 -40.28 75.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.348 -0.842 . . . . 92.27 109.583 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.15 -49.74 73.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 123.723 0.64 . . . . 103.76 111.644 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.69 -31.58 71.64 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 113.687 0.995 . . . . 106.14 113.687 175.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.24 -50.49 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-O 119.329 -0.367 . . . . 108.59 110.494 168.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 ttmt . . . . . 0 N--CA 1.469 0.523 0 O-C-N 123.535 0.522 . . . . 108.88 111.576 176.949 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.72 ' CB ' ' CA ' ' A' ' 7' ' ' ALA 1.634 . . . . . . . 0 N--CA 1.505 2.313 0 N-CA-C 115.575 1.695 . . . . 101.91 115.575 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.46 27.52 3.09 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.499 0.926 . . . . 104.9 113.499 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -64.93 -24.33 67.49 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 113.107 0.78 . . . . 106.93 113.107 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.92 -29.98 44.83 Favored Glycine 0 N--CA 1.474 1.167 0 N-CA-C 115.573 0.989 . . . . 100.26 115.573 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.1 m -78.38 -24.7 46.24 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.999 0.428 . . . . 94.82 111.586 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.95 -39.33 0.83 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.911 1.284 . . . . 95.46 113.855 176.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -68.55 -37.93 80.34 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 123.276 0.36 . . . . 126.52 111.717 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -79.51 -43.9 9.94 Favored Glycine 0 N--CA 1.47 0.949 0 CA-C-O 121.337 0.41 . . . . 97.31 113.673 -177.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 30.8 mtm -50.31 -39.99 47.31 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.799 1.407 . . . . 81.15 114.799 166.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.94 -46.29 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 CA-C-N 117.935 0.334 . . . . 70.74 111.836 173.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.0 mt -59.43 -35.18 73.52 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.426 0.528 . . . . 79.18 112.426 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -58.89 -49.35 78.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.026 -0.534 . . . . 91.44 112.173 172.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 48.1 tpt85 -59.55 -51.75 68.51 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.862 0.69 . . . . 85.11 112.862 175.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.632 HG22 HD22 ' A' ' 78' ' ' LEU . 36.0 mt -55.57 -21.21 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.427 0 N-CA-C 112.679 0.622 . . . . 82.9 112.679 174.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.7 p -74.91 -21.27 59.31 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 115.184 1.549 . . . . 95.38 115.184 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.9 73.13 0.8 Allowed 'General case' 0 C--N 1.33 -0.262 0 O-C-N 123.358 0.411 . . . . 109.34 109.936 -178.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.7 142.46 12.64 Favored Glycine 0 N--CA 1.473 1.123 0 N-CA-C 117.51 1.764 . . . . 96.02 117.51 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -50.28 138.77 16.04 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 123.837 0.855 . . . . 88.31 110.382 169.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.0 t -158.35 175.24 13.98 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.108 0.781 . . . . 75.63 113.108 -172.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -144.64 149.97 36.59 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 123.501 0.72 . . . . 83.61 109.812 -166.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.405 ' HA3' ' CZ ' ' A' ' 48' ' ' TYR . . . -32.05 -56.59 0.4 Allowed Glycine 0 N--CA 1.468 0.796 0 N-CA-C 118.241 2.056 . . . . 63.33 118.241 -171.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -56.51 -51.18 69.5 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 114.252 1.204 . . . . 91.77 114.252 175.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -58.78 -43.29 90.38 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 109.927 -0.397 . . . . 88.81 109.927 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.5 mt -56.36 -53.44 40.1 Favored 'Isoleucine or valine' 0 C--O 1.25 1.09 0 O-C-N 124.382 1.051 . . . . 71.3 111.177 175.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . 0.425 HG21 ' HA ' ' A' ' 44' ' ' GLU . 2.9 m -62.44 -36.62 82.98 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 124.412 1.07 . . . . 70.79 111.906 -178.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . . . -69.34 -44.43 71.65 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.023 -0.732 . . . . 78.63 109.023 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.4 -42.12 77.41 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 109.062 -0.718 . . . . 84.01 109.062 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 39' ' ' PHE . 26.4 mt -58.83 -48.06 82.66 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 114.156 1.169 . . . . 79.57 114.156 174.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -56.93 -37.62 71.74 Favored 'General case' 0 CA--C 1.55 0.949 0 O-C-N 124.165 0.915 . . . . 97.08 111.757 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -70.48 -32.94 70.66 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.983 1.475 . . . . 96.12 114.983 172.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . . . -62.92 -35.29 79.6 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.195 0.443 . . . . 91.83 112.195 170.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 137.84 -30.57 2.56 Favored Glycine 0 N--CA 1.473 1.124 0 N-CA-C 120.463 2.945 . . . . 96.21 120.463 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.424 ' HE1' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -77.41 86.45 3.79 Favored 'General case' 0 N--CA 1.481 1.1 0 CA-C-N 118.165 0.983 . . . . 107.21 110.776 178.096 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -87.19 9.76 19.07 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 114.412 -1.267 . . . . 116.38 110.616 -178.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -74.96 -18.91 60.31 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 114.455 -1.248 . . . . 110.08 110.135 166.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.0 tp -59.29 152.79 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 114.024 1.12 . . . . 96.76 114.024 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -133.13 139.72 48.75 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.492 0 N-CA-C 106.987 -1.486 . . . . 93.37 106.987 177.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.425 ' HA ' HG21 ' A' ' 31' ' ' THR . 35.5 mt-10 -42.24 -45.47 4.15 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 118.921 -0.562 . . . . 90.77 111.928 175.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.03 -62.79 5.9 Favored Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.049 0.833 . . . . 84.53 114.176 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.0 m -31.81 -36.07 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.204 0 N-CA-C 116.029 1.863 . . . . 88.01 116.029 165.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 37.3 t -75.07 -45.78 41.43 Favored 'Isoleucine or valine' 0 C--O 1.249 1.069 0 CA-C-N 117.988 0.358 . . . . 78.45 111.032 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.405 ' CZ ' ' HA3' ' A' ' 27' ' ' GLY . 43.6 m-85 -59.91 -39.25 84.77 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 114.38 1.252 . . . . 84.08 114.38 -177.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.36 -41.8 97.67 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.646 0.591 . . . . 90.0 111.434 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.7 mt -63.94 -51.86 64.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.788 -0.642 . . . . 77.01 109.589 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.6 mt -44.37 -57.13 3.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.782 0.29 . . . . 68.69 111.782 171.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.3 t -50.85 -49.23 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 122.924 0.49 . . . . 76.84 111.405 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -56.83 -44.8 82.44 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.924 0.713 . . . . 95.29 112.924 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.7 -38.28 89.78 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.483 1.29 . . . . 75.03 114.483 178.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -59.5 -46.18 89.57 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.079 0.4 . . . . 79.03 112.079 169.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -72.12 -29.07 63.72 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 123.784 0.833 . . . . 96.52 111.988 -176.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -77.94 -17.12 57.59 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 108.734 -0.839 . . . . 94.98 108.734 176.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 84.28 23.73 50.31 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 115.092 0.797 . . . . 80.36 115.092 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mt -97.4 -8.99 28.19 Favored 'General case' 0 CA--C 1.565 1.533 0 N-CA-C 114.082 1.141 . . . . 80.46 114.082 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 6.5 m -129.15 154.91 40.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 121.558 -0.714 . . . . 68.91 112.389 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -110.62 140.49 44.9 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.76 -0.655 . . . . 76.77 112.102 177.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 11.8 mm -102.76 121.54 54.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.221 0 O-C-N 124.268 0.98 . . . . 70.14 112.459 -175.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -110.06 102.09 10.84 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 106.552 -1.647 . . . . 71.73 106.552 157.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt -76.59 123.0 25.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.566 -0.902 . . . . 89.78 108.566 177.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 52.0 mttt -117.77 128.19 54.63 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 123.256 0.348 . . . . 82.41 110.501 -175.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.7 tptt -89.17 158.91 17.73 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.676 0.991 . . . . 101.54 113.676 -176.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.7 p -142.71 151.07 40.93 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.648 0.737 . . . . 94.6 112.674 167.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . . . -86.52 -4.44 59.17 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.367 -0.833 . . . . 81.15 108.793 169.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . . . -88.27 -38.85 14.88 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 112.871 0.693 . . . . 89.26 112.871 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -163.48 -159.45 10.67 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 123.676 0.655 . . . . 83.78 114.034 173.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -60.73 158.81 31.18 Favored 'Trans proline' 0 C--O 1.254 1.285 0 C-N-CA 124.39 3.393 . . . . 81.21 112.965 -175.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -75.06 154.38 42.18 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 115.047 -2.835 . . . . 75.86 111.601 176.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -120.84 134.39 55.29 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 105.754 -1.943 . . . . 73.29 105.754 177.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -79.12 126.13 30.33 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.479 -0.934 . . . . 74.33 108.479 170.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -90.41 135.3 33.77 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 119.601 -0.84 . . . . 72.77 111.638 166.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -108.45 135.44 49.72 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 114.679 -1.146 . . . . 87.85 112.039 -177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 t -137.53 164.66 28.19 Favored 'General case' 0 CA--C 1.562 1.441 0 N-CA-C 106.764 -1.569 . . . . 81.39 106.764 169.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.632 HD22 HG22 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -80.38 134.6 36.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 115.021 1.489 . . . . 67.61 115.021 -179.247 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.2 p -70.58 163.44 63.52 Favored Pre-proline 0 N--CA 1.472 0.633 0 CA-C-N 115.475 -0.784 . . . . 66.34 109.718 164.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -53.62 -42.4 66.25 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 117.502 -1.199 . . . . 71.28 112.993 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.55 -40.79 72.36 Favored 'General case' 0 CA--C 1.549 0.916 0 N-CA-C 114.342 1.238 . . . . 67.59 114.342 174.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -65.53 -45.46 89.72 Favored Glycine 0 N--CA 1.476 1.335 0 N-CA-C 112.033 -0.427 . . . . 64.67 112.033 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -43.75 -54.82 4.85 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.559 0.744 . . . . 81.11 111.335 164.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . . . -58.82 -51.76 68.64 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 112.951 0.723 . . . . 75.62 112.951 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -58.43 -35.14 71.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 114.703 1.372 . . . . 84.36 114.703 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 59.7 tp -71.78 -41.1 68.76 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.03 0.443 . . . . 67.42 111.684 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.39 -44.56 84.62 Favored 'General case' 0 N--CA 1.439 -1.002 0 CA-C-N 114.817 -1.083 . . . . 71.5 111.557 172.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 8.2 mt -56.58 -49.45 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.831 0.452 . . . . 85.83 111.601 175.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -54.8 -51.36 66.05 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.92 1.288 . . . . 76.86 112.426 174.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TRP . . . . . . . . . . . . . 30.6 m95 -58.12 -46.81 84.94 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 113.55 0.945 . . . . 74.01 113.55 177.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . . . -53.11 -42.01 65.57 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.635 1.174 . . . . 81.43 111.276 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.23 -45.33 88.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.701 1.0 . . . . 93.75 113.701 173.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TRP . . . . . 0.427 ' HE3' ' HG3' ' A' ' 97' ' ' GLN . 17.2 m95 -59.24 -49.88 76.14 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 119.851 -0.739 . . . . 89.39 111.62 173.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -48.6 -49.96 34.63 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 123.867 0.73 . . . . 84.89 111.907 172.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -55.17 -51.43 66.54 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 113.296 0.85 . . . . 104.88 113.296 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.451 ' O ' HG12 ' A' ' 100' ' ' ILE . 1.3 tp -77.59 -32.04 18.01 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 N-CA-C 114.052 1.131 . . . . 90.59 114.052 -174.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLN . . . . . 0.427 ' HG3' ' HE3' ' A' ' 93' ' ' TRP . 36.9 mt-30 -64.1 -47.24 80.81 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.926 -0.768 . . . . 88.87 108.926 173.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -56.58 -45.67 89.7 Favored Glycine 0 C--N 1.331 0.286 0 N-CA-C 115.343 0.897 . . . . 79.15 115.343 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.5 mttt -71.6 -46.22 59.87 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 112.371 0.508 . . . . 130.99 112.371 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 96' ' ' ILE . 5.1 mm -53.24 -47.42 56.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 O-C-N 123.768 0.667 . . . . 95.36 110.454 174.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 3.8 ttm -70.83 -30.34 66.74 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 124.068 0.855 . . . . 120.58 111.838 -176.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.24 -46.25 84.59 Favored 'General case' 0 N--CA 1.461 0.117 0 O-C-N 123.873 0.733 . . . . 113.93 111.025 172.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.499 HG13 ' OH ' ' B' ' 33' ' ' TYR . 61.8 t -52.49 -55.6 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.258 0.349 . . . . 100.24 110.323 170.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 47.5 tttm . . . . . 0 N--CA 1.471 0.597 0 C-N-CA 125.528 1.531 . . . . 89.43 114.685 -176.671 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 stop_ save_