data_6akv_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 6akv _Structure_validation_residue.Date_analyzed 2019-02-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.966 0.413 . . . . 61.95 111.648 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 79.3 mtp -101.55 144.54 30.17 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.965 -0.383 . . . . 61.57 109.965 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.51 140.79 38.54 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.024 -0.67 . . . . 54.35 109.566 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.28 -38.51 65.94 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.336 -0.946 . . . . 47.89 110.73 171.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -54.19 -47.46 72.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.298 -0.561 . . . . 53.35 111.808 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.1 m -60.18 -44.31 95.15 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 121.888 -0.507 . . . . 47.11 111.773 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.2 mt -62.08 -47.53 84.24 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.911 -0.315 . . . . 42.92 111.343 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.5 mt -71.46 -29.67 36.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 119.397 -0.921 . . . . 40.38 111.064 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.27 -46.75 79.22 Favored 'General case' 0 C--O 1.239 0.536 0 O-C-N 121.456 -0.777 . . . . 62.39 111.193 176.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -71.28 -36.74 71.8 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.745 -0.782 . . . . 63.76 111.134 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.94 -39.58 90.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 120.146 -0.622 . . . . 34.23 111.069 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -65.4 -19.21 65.84 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.282 0.475 . . . . 38.09 112.282 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.0 mtm105 -58.86 -33.96 71.05 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.465 -0.894 . . . . 90.19 110.918 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -94.93 -41.12 9.34 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.89 0.7 . . . . 65.49 112.89 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.2 mt -74.3 -23.48 59.09 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.439 0.533 . . . . 40.03 112.439 -166.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASN . . . . . 0.645 ' OD1' ' NH2' ' A' ' 30' ' ' ARG . 96.7 m-20 -103.19 13.92 32.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.972 0.73 . . . . 43.05 112.972 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.5 t -69.37 142.46 16.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.14 -0.689 . . . . 40.12 109.14 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.5 t -60.05 109.8 1.05 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.042 -0.526 . . . . 59.17 110.306 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 402' ' ' HOH . . . 133.95 -31.67 2.78 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.789 -0.924 . . . . 39.97 110.789 -174.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 50.4 mmm -67.67 143.79 55.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 117.104 0.452 . . . . 40.81 110.102 171.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 64.3 mtp85 -82.11 145.8 29.95 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.908 -0.587 . . . . 47.73 110.144 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . 0.42 ' N ' ' OD2' ' A' ' 147' ' ' ASP . 19.6 mmtm -71.32 -34.77 70.87 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.4 -0.92 . . . . 75.94 111.187 -175.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.3 p-10 -69.41 -27.04 64.94 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 119.623 -0.831 . . . . 41.37 111.757 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.1 t -75.81 -40.75 39.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 C-N-CA 118.901 -1.119 . . . . 26.92 110.151 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.84 -46.68 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.04 0.385 . . . . 29.2 112.04 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -68.33 -45.4 73.0 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.1 0.407 . . . . 50.22 112.1 -174.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 67.4 mtt180 -63.59 -31.17 72.26 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.835 -0.746 . . . . 50.07 111.693 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.2 m -72.62 -38.93 67.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 118.63 -1.228 . . . . 34.13 110.972 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . 0.645 ' NH2' ' OD1' ' A' ' 17' ' ' ASN . 67.4 mtt85 -63.27 -36.88 85.15 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.203 -0.999 . . . . 46.26 111.054 176.256 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.15 -44.78 94.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.602 -0.839 . . . . 31.64 110.583 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.23 -45.45 96.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 120.731 0.301 . . . . 36.87 110.572 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.5 mt -55.56 -42.11 66.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 C-N-CA 120.39 -0.524 . . . . 42.22 110.335 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.5 m -69.3 -48.77 60.65 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.857 -0.527 . . . . 36.31 111.093 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -61.51 -34.07 74.89 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.345 0.498 . . . . 70.74 112.345 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.9 mmt -77.39 -36.01 53.79 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.807 -0.558 . . . . 49.63 112.341 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -61.7 -35.79 79.03 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.514 -0.475 . . . . 57.58 111.321 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.25 -25.7 10.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.21 0.448 . . . . 56.15 112.21 172.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -107.34 27.3 9.22 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.293 0.637 . . . . 69.87 112.543 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.02 3.01 34.1 Favored Glycine 0 C--N 1.333 0.398 0 N-CA-C 115.695 1.038 . . . . 56.82 115.695 176.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 21.5 mt -94.44 119.14 41.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-N 118.621 1.21 . . . . 47.94 108.755 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -106.35 112.36 25.34 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.912 -1.144 . . . . 64.05 107.912 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 90.4 mt -89.36 138.11 19.94 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.086 0.47 . . . . 36.12 109.841 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 48.2 t -106.37 136.43 46.13 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.24 1.016 . . . . 44.37 109.764 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.5 t -100.2 99.82 9.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 106.381 -1.711 . . . . 37.03 106.381 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.94 27.07 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.489 0.551 . . . . 38.37 112.489 -172.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -137.69 137.09 38.01 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.875 -0.787 . . . . 56.17 108.875 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.81 -104.13 1.84 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.268 -1.133 . . . . 31.45 110.268 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -97.54 137.22 36.81 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.593 -0.892 . . . . 33.78 108.593 -179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 68.7 mtm-85 -122.06 132.84 54.71 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.722 -0.844 . . . . 37.83 108.722 175.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 84.0 p -74.04 175.19 7.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.806 -1.158 . . . . 39.74 110.038 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -64.13 -41.59 97.15 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 114.798 -1.092 . . . . 34.84 110.345 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.46 -46.58 69.42 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.429 -0.17 . . . . 34.45 111.43 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -58.82 -37.51 76.58 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.214 -0.594 . . . . 65.76 111.457 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -66.73 -42.97 85.43 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.703 -0.399 . . . . 30.87 111.345 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -64.42 -27.06 68.74 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.675 -0.81 . . . . 31.78 111.423 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.82 -44.27 73.83 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.478 -0.889 . . . . 37.93 111.111 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.55 -44.81 95.71 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.194 -0.602 . . . . 34.87 111.272 175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.4 -36.33 79.97 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.983 -0.287 . . . . 32.05 111.101 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.12 69.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.396 0.517 . . . . 34.35 112.396 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -67.19 122.08 17.06 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.522 -0.547 . . . . 66.15 109.522 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.72 5.28 89.46 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-O 118.98 -0.9 . . . . 37.41 114.919 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -124.0 -61.49 1.36 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.461 1.131 . . . . 34.5 111.641 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 27.1 p -113.21 10.22 18.54 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.348 0.522 . . . . 33.87 111.936 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -160.72 156.36 21.78 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 108.332 -0.988 . . . . 40.24 108.332 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -58.61 161.07 15.54 Favored 'Trans proline' 0 C--O 1.233 0.233 0 CA-C-O 122.054 0.773 . . . . 51.25 112.127 -173.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.33 -176.08 16.26 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-O 122.312 0.951 . . . . 50.49 112.23 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 43.5 t -101.9 143.75 31.39 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 114.07 -1.065 . . . . 62.25 110.086 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 mm -64.12 111.81 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.892 -0.595 . . . . 45.5 109.833 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 17.7 m -102.88 -29.59 2.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 122.395 0.278 . . . . 42.79 111.425 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.3 t -141.27 163.81 31.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.611 0.72 . . . . 41.67 110.301 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -117.6 7.98 12.75 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 113.395 0.887 . . . . 65.53 113.395 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.71 130.64 54.92 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 118.412 0.551 . . . . 35.46 110.777 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.4 mtt85 -70.7 165.93 21.93 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.651 0.739 . . . . 76.04 110.028 163.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -49.76 130.2 26.75 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.229 -0.896 . . . . 27.4 111.635 170.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 91.47 -16.56 58.74 Favored Glycine 0 N--CA 1.44 -1.052 0 CA-C-O 119.086 -0.841 . . . . 31.61 114.638 -174.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -103.84 0.39 30.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 118.399 1.099 . . . . 44.55 113.832 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.2 t -105.01 143.87 32.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 118.874 0.761 . . . . 27.4 110.364 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -70.82 -16.5 62.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.465 -0.894 . . . . 30.23 112.01 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -64.62 -19.73 65.86 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.701 0.63 . . . . 35.78 112.701 166.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -75.16 -6.13 47.99 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.666 -1.214 . . . . 32.13 112.249 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -120.87 5.27 10.46 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 113.146 0.795 . . . . 33.07 113.146 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.23 21.27 79.85 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 114.984 0.754 . . . . 28.42 114.984 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 22.0 m -108.07 4.44 9.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 118.109 0.955 . . . . 26.44 112.494 -177.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -134.16 144.97 48.83 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.691 0.678 . . . . 24.18 110.541 -171.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.3 m -130.77 151.23 35.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 121.911 0.862 . . . . 29.57 109.677 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -110.73 119.96 40.85 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.088 -0.96 . . . . 35.76 109.151 171.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 mt -111.7 133.94 53.6 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.453 1.101 . . . . 40.35 110.749 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 8.6 p -125.33 -173.88 2.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.378 -0.971 . . . . 43.16 108.378 161.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.6 mt -107.94 155.28 20.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.59 0.709 . . . . 46.31 110.755 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -95.47 146.85 24.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.994 -1.003 . . . . 52.21 109.225 172.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 31.3 p -58.26 158.58 7.0 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.56 -0.856 . . . . 65.28 109.686 165.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -59.47 -15.43 17.48 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.749 -0.659 . . . . 76.89 112.456 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -112.89 -1.53 14.56 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 113.717 1.006 . . . . 72.25 113.717 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 78.95 15.35 80.78 Favored Glycine 0 C--N 1.334 0.445 0 N-CA-C 116.23 1.252 . . . . 63.06 116.23 177.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.8 p -88.13 -18.42 28.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 118.433 1.117 . . . . 64.77 113.221 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -152.74 164.74 37.19 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.658 -0.868 . . . . 81.36 108.658 -175.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.64 159.61 13.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 122.155 0.979 . . . . 65.54 109.052 175.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 pt -134.86 131.24 53.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 107.882 -1.155 . . . . 55.57 107.882 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -100.1 104.96 16.55 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 106.223 -1.769 . . . . 52.79 106.223 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 t -151.74 147.52 26.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.347 -1.353 . . . . 65.21 107.347 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 18.6 m -102.17 8.0 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.515 -0.766 . . . . 52.71 111.198 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -96.75 148.84 22.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.715 1.206 . . . . 82.99 111.199 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.53 -105.37 1.13 Allowed Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.702 -1.135 . . . . 66.82 114.161 168.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -67.66 -32.74 73.62 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.591 -0.844 . . . . 60.0 111.848 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -65.23 -14.24 60.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.763 -0.775 . . . . 58.83 112.672 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . 0.472 ' NH1' 'CL ' ' A' ' 303' ' ' ' CL' . 7.4 mmm180 -80.59 -19.74 44.87 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.442 0.565 . . . . 92.01 111.96 176.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -75.02 -36.79 61.91 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.662 -0.815 . . . . 66.08 111.211 167.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 81.6 t -57.98 -47.95 85.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.182 0.515 . . . . 37.75 110.792 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.6 mt -61.41 -40.15 85.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.15 -0.62 . . . . 45.23 110.279 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.45 -39.35 93.11 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.301 -0.56 . . . . 36.18 110.945 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -75.34 -38.55 60.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.127 -0.629 . . . . 33.02 111.036 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 84.6 mmm -65.42 -41.14 93.9 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.445 -0.502 . . . . 36.59 110.83 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -63.04 -36.97 85.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.676 -0.81 . . . . 40.33 110.398 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.0 -30.58 71.64 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.331 -0.548 . . . . 38.63 111.479 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -78.27 -7.05 56.74 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.378 0.881 . . . . 41.82 113.378 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 110.88 0.55 28.74 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 118.875 -0.959 . . . . 40.59 115.372 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.8 154.78 38.16 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.79 1.295 . . . . 37.53 110.415 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -101.23 142.69 32.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.831 -1.174 . . . . 74.82 107.831 164.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -99.55 134.69 42.07 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.746 -0.381 . . . . 49.96 110.247 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -73.4 -6.57 70.61 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.312 -0.715 . . . . 51.56 114.818 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.63 -6.09 89.13 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 118.013 0.907 . . . . 52.91 114.503 168.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -94.76 -9.11 35.64 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.122 0.961 . . . . 59.05 113.42 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TRP . . . . . . . . . . . . . 10.5 m0 -71.36 139.96 50.01 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.348 -0.612 . . . . 63.72 109.348 167.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 13.9 m -91.03 -40.01 12.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 119.205 -0.998 . . . . 68.56 110.984 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 44.2 t -93.01 -30.11 15.49 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.317 -0.864 . . . . 75.72 112.754 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -83.45 -75.79 0.31 Allowed 'General case' 0 C--O 1.239 0.549 0 N-CA-C 109.572 -0.529 . . . . 92.92 109.572 172.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 14.1 ttmm 64.58 92.16 0.07 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.91 0.884 . . . . 73.51 111.025 176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -124.03 97.07 5.18 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.134 1.774 . . . . 64.9 106.45 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -72.19 -39.71 6.78 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 115.097 1.517 . . . . 95.45 115.097 -160.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -80.63 12.05 2.72 Favored 'Trans proline' 0 C--O 1.232 0.187 0 N-CA-C 115.133 1.166 . . . . 37.26 115.133 177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -114.22 129.59 56.63 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 119.716 1.144 . . . . 33.46 111.118 -158.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -130.58 141.24 50.45 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.597 0.56 . . . . 34.67 110.011 175.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -125.57 128.93 48.7 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.5 1.52 . . . . 44.41 110.983 -178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.35 -33.69 28.77 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.337 -0.945 . . . . 35.44 111.934 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -135.78 149.54 49.16 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.405 -0.961 . . . . 42.01 108.405 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -97.76 72.29 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.329 1.061 . . . . 45.65 109.344 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 73.2 t -57.89 -39.16 70.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-N 114.415 -1.266 . . . . 39.76 110.946 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.25 -35.67 58.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 119.783 -0.767 . . . . 41.81 110.735 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -75.49 7.17 26.72 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.739 1.056 . . . . 49.64 115.739 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 99.0 3.05 56.99 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 117.003 1.561 . . . . 62.26 117.003 176.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -74.92 137.98 42.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 118.9 1.35 . . . . 56.9 110.285 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -104.58 117.38 59.17 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 109.346 -0.613 . . . . 81.84 109.346 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -68.25 150.85 76.88 Favored 'Trans proline' 0 C--O 1.241 0.657 0 CA-C-N 119.343 0.801 . . . . 50.98 110.673 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.54 167.0 20.04 Favored 'Trans proline' 0 C--O 1.235 0.337 0 N-CA-C 109.765 -0.898 . . . . 56.02 109.765 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.06 145.45 30.7 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.279 -0.969 . . . . 62.51 109.25 175.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ASP . . . . . 0.42 ' OD2' ' N ' ' A' ' 23' ' ' LYS . 37.3 t0 -71.03 102.37 2.42 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 60.64 109.725 -170.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -95.03 -28.54 15.07 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.391 0.515 . . . . 87.94 112.391 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.46 -161.68 24.19 Favored Glycine 0 N--CA 1.448 -0.543 0 CA-C-O 122.234 0.908 . . . . 69.5 112.217 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 84.49 145.8 7.35 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 116.617 1.407 . . . . 68.72 116.617 170.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -90.39 -152.95 0.28 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.194 0.598 . . . . 76.43 111.263 178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.467 0.395 0 CA-C-O 121.012 0.434 . . . . 72.19 111.056 -177.216 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' ' CL' . . . . . 0.472 'CL ' ' NH1' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . 0.452 ' O ' ' N ' ' A' ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.966 0.413 . . . . 61.95 111.648 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 79.3 mtp -101.55 144.54 30.17 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.965 -0.383 . . . . 61.57 109.965 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.51 140.79 38.54 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.024 -0.67 . . . . 54.35 109.566 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.28 -38.51 65.94 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.336 -0.946 . . . . 47.89 110.73 171.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -54.19 -47.46 72.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.298 -0.561 . . . . 53.35 111.808 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.1 m -60.18 -44.31 95.15 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 121.888 -0.507 . . . . 47.11 111.773 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.2 mt -62.08 -47.53 84.24 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.911 -0.315 . . . . 42.92 111.343 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.5 mt -71.46 -29.67 36.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 119.397 -0.921 . . . . 40.38 111.064 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.27 -46.75 79.22 Favored 'General case' 0 C--O 1.239 0.536 0 O-C-N 121.456 -0.777 . . . . 62.39 111.193 176.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -71.28 -36.74 71.8 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.745 -0.782 . . . . 63.76 111.134 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.94 -39.58 90.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 120.146 -0.622 . . . . 34.23 111.069 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -65.4 -19.21 65.84 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.282 0.475 . . . . 38.09 112.282 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.0 mtm105 -58.86 -33.96 71.05 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.465 -0.894 . . . . 90.19 110.918 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -94.93 -41.12 9.34 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.89 0.7 . . . . 65.49 112.89 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.2 mt -74.3 -23.48 59.09 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.439 0.533 . . . . 40.03 112.439 -166.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASN . . . . . 0.645 ' OD1' ' NH2' ' A' ' 30' ' ' ARG . 96.7 m-20 -103.19 13.92 32.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.972 0.73 . . . . 43.05 112.972 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.5 t -69.37 142.46 16.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.14 -0.689 . . . . 40.12 109.14 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.5 t -60.05 109.8 1.05 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.042 -0.526 . . . . 59.17 110.306 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.95 -31.67 2.78 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.789 -0.924 . . . . 39.97 110.789 -174.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 50.4 mmm -67.67 143.79 55.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 117.104 0.452 . . . . 40.81 110.102 171.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HD3' HG12 ' A' ' 84' ' ' VAL . 64.3 mtp85 -82.11 145.8 29.95 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.908 -0.587 . . . . 47.73 110.144 174.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG2' ' OD2' ' A' ' 147' ' ' ASP . 19.6 mmtm -71.32 -34.77 70.87 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.4 -0.92 . . . . 75.94 111.187 -175.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 46.3 p-10 -69.41 -27.04 64.94 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 119.623 -0.831 . . . . 41.37 111.757 179.029 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.1 t -75.81 -40.75 39.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 C-N-CA 118.901 -1.119 . . . . 26.92 110.151 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.84 -46.68 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.04 0.385 . . . . 29.2 112.04 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -68.33 -45.4 73.0 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.1 0.407 . . . . 50.22 112.1 -174.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HG2' ' HA ' ' A' ' 151' ' ' ALA . 67.4 mtt180 -63.59 -31.17 72.26 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.835 -0.746 . . . . 50.07 111.693 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.2 m -72.62 -38.93 67.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 118.63 -1.228 . . . . 34.13 110.972 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.645 ' NH2' ' OD1' ' A' ' 17' ' ' ASN . 67.4 mtt85 -63.27 -36.88 85.15 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.203 -0.999 . . . . 46.26 111.054 176.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.15 -44.78 94.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.602 -0.839 . . . . 31.64 110.583 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.23 -45.45 96.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 120.731 0.301 . . . . 36.87 110.572 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.5 mt -55.56 -42.11 66.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 C-N-CA 120.39 -0.524 . . . . 42.22 110.335 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.5 m -69.3 -48.77 60.65 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.857 -0.527 . . . . 36.31 111.093 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -61.51 -34.07 74.89 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.345 0.498 . . . . 70.74 112.345 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.9 mmt -77.39 -36.01 53.79 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.807 -0.558 . . . . 49.63 112.341 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -61.7 -35.79 79.03 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.514 -0.475 . . . . 57.58 111.321 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.25 -25.7 10.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.21 0.448 . . . . 56.15 112.21 172.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -107.34 27.3 9.22 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.293 0.637 . . . . 69.87 112.543 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.02 3.01 34.1 Favored Glycine 0 C--N 1.333 0.398 0 N-CA-C 115.695 1.038 . . . . 56.82 115.695 176.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 21.5 mt -94.44 119.14 41.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-N 118.621 1.21 . . . . 47.94 108.755 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -106.35 112.36 25.34 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.912 -1.144 . . . . 64.05 107.912 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 90.4 mt -89.36 138.11 19.94 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.086 0.47 . . . . 36.12 109.841 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 48.2 t -106.37 136.43 46.13 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.24 1.016 . . . . 44.37 109.764 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.5 t -100.2 99.82 9.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 106.381 -1.711 . . . . 37.03 106.381 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.94 27.07 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.489 0.551 . . . . 38.37 112.489 -172.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -137.69 137.09 38.01 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.875 -0.787 . . . . 56.17 108.875 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.81 -104.13 1.84 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.268 -1.133 . . . . 31.45 110.268 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -97.54 137.22 36.81 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.593 -0.892 . . . . 33.78 108.593 -179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 68.7 mtm-85 -122.06 132.84 54.71 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.722 -0.844 . . . . 37.83 108.722 175.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 84.0 p -74.04 175.19 7.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.806 -1.158 . . . . 39.74 110.038 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -64.13 -41.59 97.15 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 114.798 -1.092 . . . . 34.84 110.345 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.46 -46.58 69.42 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.429 -0.17 . . . . 34.45 111.43 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -58.82 -37.51 76.58 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.214 -0.594 . . . . 65.76 111.457 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -66.73 -42.97 85.43 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.703 -0.399 . . . . 30.87 111.345 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -64.42 -27.06 68.74 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.675 -0.81 . . . . 31.78 111.423 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.82 -44.27 73.83 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.478 -0.889 . . . . 37.93 111.111 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.55 -44.81 95.71 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.194 -0.602 . . . . 34.87 111.272 175.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.4 -36.33 79.97 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.983 -0.287 . . . . 32.05 111.101 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.12 69.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.396 0.517 . . . . 34.35 112.396 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -67.19 122.08 17.06 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.522 -0.547 . . . . 66.15 109.522 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.72 5.28 89.46 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-O 118.98 -0.9 . . . . 37.41 114.919 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -124.0 -61.49 1.36 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.461 1.131 . . . . 34.5 111.641 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 27.1 p -113.21 10.22 18.54 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.348 0.522 . . . . 33.87 111.936 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -160.72 156.36 21.78 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 108.332 -0.988 . . . . 40.24 108.332 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -58.61 161.07 15.54 Favored 'Trans proline' 0 C--O 1.233 0.233 0 CA-C-O 122.054 0.773 . . . . 51.25 112.127 -173.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.33 -176.08 16.26 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-O 122.312 0.951 . . . . 50.49 112.23 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 43.5 t -101.9 143.75 31.39 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 114.07 -1.065 . . . . 62.25 110.086 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 mm -64.12 111.81 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.892 -0.595 . . . . 45.5 109.833 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 17.7 m -102.88 -29.59 2.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 122.395 0.278 . . . . 42.79 111.425 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.3 t -141.27 163.81 31.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.611 0.72 . . . . 41.67 110.301 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -117.6 7.98 12.75 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 113.395 0.887 . . . . 65.53 113.395 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.71 130.64 54.92 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 118.412 0.551 . . . . 35.46 110.777 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.4 mtt85 -70.7 165.93 21.93 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.651 0.739 . . . . 76.04 110.028 163.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -49.76 130.2 26.75 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.229 -0.896 . . . . 27.4 111.635 170.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 91.47 -16.56 58.74 Favored Glycine 0 N--CA 1.44 -1.052 0 CA-C-O 119.086 -0.841 . . . . 31.61 114.638 -174.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -103.84 0.39 30.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 118.399 1.099 . . . . 44.55 113.832 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.2 t -105.01 143.87 32.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 118.874 0.761 . . . . 27.4 110.364 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -70.82 -16.5 62.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.465 -0.894 . . . . 30.23 112.01 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -64.62 -19.73 65.86 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.701 0.63 . . . . 35.78 112.701 166.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -75.16 -6.13 47.99 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.666 -1.214 . . . . 32.13 112.249 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -120.87 5.27 10.46 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 113.146 0.795 . . . . 33.07 113.146 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.23 21.27 79.85 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 114.984 0.754 . . . . 28.42 114.984 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . 0.467 HG12 ' HD3' ' A' ' 22' ' ' ARG . 22.0 m -108.07 4.44 9.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 118.109 0.955 . . . . 26.44 112.494 -177.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -134.16 144.97 48.83 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.691 0.678 . . . . 24.18 110.541 -171.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.3 m -130.77 151.23 35.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 121.911 0.862 . . . . 29.57 109.677 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HA ' ' O ' ' A' ' 131' ' ' PRO . 91.2 m-20 -110.73 119.96 40.85 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.088 -0.96 . . . . 35.76 109.151 171.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 mt -111.7 133.94 53.6 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.453 1.101 . . . . 40.35 110.749 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 8.6 p -125.33 -173.88 2.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.378 -0.971 . . . . 43.16 108.378 161.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.6 mt -107.94 155.28 20.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.59 0.709 . . . . 46.31 110.755 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -95.47 146.85 24.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.994 -1.003 . . . . 52.21 109.225 172.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 97' ' ' ASP . 31.3 p -58.26 158.58 7.0 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.56 -0.856 . . . . 65.28 109.686 165.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -59.47 -15.43 17.48 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.749 -0.659 . . . . 76.89 112.456 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -112.89 -1.53 14.56 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 113.717 1.006 . . . . 72.25 113.717 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 78.95 15.35 80.78 Favored Glycine 0 C--N 1.334 0.445 0 N-CA-C 116.23 1.252 . . . . 63.06 116.23 177.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.8 p -88.13 -18.42 28.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 118.433 1.117 . . . . 64.77 113.221 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 92' ' ' THR . 31.1 t70 -152.74 164.74 37.19 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.658 -0.868 . . . . 81.36 108.658 -175.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.64 159.61 13.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 122.155 0.979 . . . . 65.54 109.052 175.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 pt -134.86 131.24 53.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 107.882 -1.155 . . . . 55.57 107.882 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -100.1 104.96 16.55 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 106.223 -1.769 . . . . 52.79 106.223 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 t -151.74 147.52 26.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.347 -1.353 . . . . 65.21 107.347 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . 0.537 HG11 ' CD2' ' A' ' 130' ' ' TYR . 18.6 m -102.17 8.0 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.515 -0.766 . . . . 52.71 111.198 174.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -96.75 148.84 22.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.715 1.206 . . . . 82.99 111.199 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.53 -105.37 1.13 Allowed Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.702 -1.135 . . . . 66.82 114.161 168.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -67.66 -32.74 73.62 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.591 -0.844 . . . . 60.0 111.848 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -65.23 -14.24 60.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.763 -0.775 . . . . 58.83 112.672 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.472 ' NH1' 'CL ' ' A' ' 303' ' ' ' CL' . 7.4 mmm180 -80.59 -19.74 44.87 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.442 0.565 . . . . 92.01 111.96 176.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -75.02 -36.79 61.91 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.662 -0.815 . . . . 66.08 111.211 167.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 81.6 t -57.98 -47.95 85.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.182 0.515 . . . . 37.75 110.792 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.6 mt -61.41 -40.15 85.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.15 -0.62 . . . . 45.23 110.279 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.45 -39.35 93.11 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.301 -0.56 . . . . 36.18 110.945 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -75.34 -38.55 60.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.127 -0.629 . . . . 33.02 111.036 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 84.6 mmm -65.42 -41.14 93.9 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.445 -0.502 . . . . 36.59 110.83 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -63.04 -36.97 85.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.676 -0.81 . . . . 40.33 110.398 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.0 -30.58 71.64 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.331 -0.548 . . . . 38.63 111.479 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -78.27 -7.05 56.74 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.378 0.881 . . . . 41.82 113.378 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 110.88 0.55 28.74 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 118.875 -0.959 . . . . 40.59 115.372 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.8 154.78 38.16 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.79 1.295 . . . . 37.53 110.415 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -101.23 142.69 32.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.831 -1.174 . . . . 74.82 107.831 164.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -99.55 134.69 42.07 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.746 -0.381 . . . . 49.96 110.247 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -73.4 -6.57 70.61 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.312 -0.715 . . . . 51.56 114.818 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.63 -6.09 89.13 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 118.013 0.907 . . . . 52.91 114.503 168.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -94.76 -9.11 35.64 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.122 0.961 . . . . 59.05 113.42 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TRP . . . . . 0.435 ' HB2' ' H ' ' A' ' 128' ' ' LYS . 10.5 m0 -71.36 139.96 50.01 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.348 -0.612 . . . . 63.72 109.348 167.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 13.9 m -91.03 -40.01 12.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 119.205 -0.998 . . . . 68.56 110.984 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 44.2 t -93.01 -30.11 15.49 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.317 -0.864 . . . . 75.72 112.754 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -83.45 -75.79 0.31 Allowed 'General case' 0 C--O 1.239 0.549 0 N-CA-C 109.572 -0.529 . . . . 92.92 109.572 172.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LYS . . . . . 0.548 ' HD3' ' OH ' ' A' ' 130' ' ' TYR . 14.1 ttmm 64.58 92.16 0.07 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.91 0.884 . . . . 73.51 111.025 176.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -124.03 97.07 5.18 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.134 1.774 . . . . 64.9 106.45 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' TYR . . . . . 0.548 ' OH ' ' HD3' ' A' ' 128' ' ' LYS . 38.0 m-85 -72.19 -39.71 6.78 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 115.097 1.517 . . . . 95.45 115.097 -160.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' PRO . . . . . 0.459 ' O ' ' HA ' ' A' ' 87' ' ' ASP . 85.7 Cg_endo -80.63 12.05 2.72 Favored 'Trans proline' 0 C--O 1.232 0.187 0 N-CA-C 115.133 1.166 . . . . 37.26 115.133 177.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HIS . . . . . 0.444 ' HE2' ' HG3' ' A' ' 134' ' ' GLU . 51.5 t60 -114.22 129.59 56.63 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 119.716 1.144 . . . . 33.46 111.118 -158.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -130.58 141.24 50.45 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.597 0.56 . . . . 34.67 110.011 175.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . 0.444 ' HG3' ' HE2' ' A' ' 132' ' ' HIS . 82.7 mt-10 -125.57 128.93 48.7 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.5 1.52 . . . . 44.41 110.983 -178.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.35 -33.69 28.77 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.337 -0.945 . . . . 35.44 111.934 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -135.78 149.54 49.16 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.405 -0.961 . . . . 42.01 108.405 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -97.76 72.29 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.329 1.061 . . . . 45.65 109.344 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 73.2 t -57.89 -39.16 70.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-N 114.415 -1.266 . . . . 39.76 110.946 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.25 -35.67 58.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 119.783 -0.767 . . . . 41.81 110.735 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -75.49 7.17 26.72 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.739 1.056 . . . . 49.64 115.739 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 99.0 3.05 56.99 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 117.003 1.561 . . . . 62.26 117.003 176.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -74.92 137.98 42.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 118.9 1.35 . . . . 56.9 110.285 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -104.58 117.38 59.17 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 109.346 -0.613 . . . . 81.84 109.346 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -68.25 150.85 76.88 Favored 'Trans proline' 0 C--O 1.241 0.657 0 CA-C-N 119.343 0.801 . . . . 50.98 110.673 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.54 167.0 20.04 Favored 'Trans proline' 0 C--O 1.235 0.337 0 N-CA-C 109.765 -0.898 . . . . 56.02 109.765 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.06 145.45 30.7 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.279 -0.969 . . . . 62.51 109.25 175.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ASP . . . . . 0.407 ' OD2' ' HG2' ' A' ' 23' ' ' LYS . 37.3 t0 -71.03 102.37 2.42 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 60.64 109.725 -170.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -95.03 -28.54 15.07 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.391 0.515 . . . . 87.94 112.391 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.46 -161.68 24.19 Favored Glycine 0 N--CA 1.448 -0.543 0 CA-C-O 122.234 0.908 . . . . 69.5 112.217 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 84.49 145.8 7.35 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 116.617 1.407 . . . . 68.72 116.617 170.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . 0.516 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . . . -90.39 -152.95 0.28 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.194 0.598 . . . . 76.43 111.263 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.467 0.395 0 CA-C-O 121.012 0.434 . . . . 72.19 111.056 -177.216 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' ' CL' . . . . . 0.472 'CL ' ' NH1' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.364 0 CA-C-O 120.966 0.413 . . . . 61.95 111.648 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 79.3 mtp -101.55 144.54 30.17 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 109.965 -0.383 . . . . 61.57 109.965 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -78.51 140.79 38.54 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.024 -0.67 . . . . 54.35 109.566 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.28 -38.51 65.94 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.336 -0.946 . . . . 47.89 110.73 171.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -54.19 -47.46 72.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.298 -0.561 . . . . 53.35 111.808 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.1 m -60.18 -44.31 95.15 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 121.888 -0.507 . . . . 47.11 111.773 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.2 mt -62.08 -47.53 84.24 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.911 -0.315 . . . . 42.92 111.343 -176.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.5 mt -71.46 -29.67 36.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 119.397 -0.921 . . . . 40.38 111.064 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -65.27 -46.75 79.22 Favored 'General case' 0 C--O 1.239 0.536 0 O-C-N 121.456 -0.777 . . . . 62.39 111.193 176.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 64.9 mttm -71.28 -36.74 71.8 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.745 -0.782 . . . . 63.76 111.134 -179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.94 -39.58 90.04 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 120.146 -0.622 . . . . 34.23 111.069 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -65.4 -19.21 65.84 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.282 0.475 . . . . 38.09 112.282 -178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.0 mtm105 -58.86 -33.96 71.05 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.465 -0.894 . . . . 90.19 110.918 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -94.93 -41.12 9.34 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.89 0.7 . . . . 65.49 112.89 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 69.2 mt -74.3 -23.48 59.09 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.439 0.533 . . . . 40.03 112.439 -166.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.645 ' OD1' ' NH2' ' A' ' 30' ' ' ARG . 96.7 m-20 -103.19 13.92 32.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.972 0.73 . . . . 43.05 112.972 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 9.5 t -69.37 142.46 16.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 N-CA-C 109.14 -0.689 . . . . 40.12 109.14 176.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.5 t -60.05 109.8 1.05 Allowed 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.042 -0.526 . . . . 59.17 110.306 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 133.95 -31.67 2.78 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.789 -0.924 . . . . 39.97 110.789 -174.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 50.4 mmm -67.67 143.79 55.8 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 117.104 0.452 . . . . 40.81 110.102 171.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HD3' HG12 ' A' ' 84' ' ' VAL . 64.3 mtp85 -82.11 145.8 29.95 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.908 -0.587 . . . . 47.73 110.144 174.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' HG2' ' OD2' ' A' ' 147' ' ' ASP . 19.6 mmtm -71.32 -34.77 70.87 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.4 -0.92 . . . . 75.94 111.187 -175.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 46.3 p-10 -69.41 -27.04 64.94 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 119.623 -0.831 . . . . 41.37 111.757 179.029 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.1 t -75.81 -40.75 39.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 C-N-CA 118.901 -1.119 . . . . 26.92 110.151 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.84 -46.68 87.15 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.04 0.385 . . . . 29.2 112.04 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -68.33 -45.4 73.0 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.1 0.407 . . . . 50.22 112.1 -174.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.516 ' HG2' ' HA ' ' A' ' 151' ' ' ALA . 67.4 mtt180 -63.59 -31.17 72.26 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.835 -0.746 . . . . 50.07 111.693 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.2 m -72.62 -38.93 67.61 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 118.63 -1.228 . . . . 34.13 110.972 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.645 ' NH2' ' OD1' ' A' ' 17' ' ' ASN . 67.4 mtt85 -63.27 -36.88 85.15 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 119.203 -0.999 . . . . 46.26 111.054 176.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.15 -44.78 94.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.602 -0.839 . . . . 31.64 110.583 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 5.6 t -64.23 -45.45 96.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 120.731 0.301 . . . . 36.87 110.572 178.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 53.5 mt -55.56 -42.11 66.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 C-N-CA 120.39 -0.524 . . . . 42.22 110.335 175.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.5 m -69.3 -48.77 60.65 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 121.857 -0.527 . . . . 36.31 111.093 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.5 tt0 -61.51 -34.07 74.89 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 112.345 0.498 . . . . 70.74 112.345 -178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.9 mmt -77.39 -36.01 53.79 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.807 -0.558 . . . . 49.63 112.341 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -61.7 -35.79 79.03 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.514 -0.475 . . . . 57.58 111.321 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.25 -25.7 10.01 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.21 0.448 . . . . 56.15 112.21 172.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -107.34 27.3 9.22 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.293 0.637 . . . . 69.87 112.543 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.02 3.01 34.1 Favored Glycine 0 C--N 1.333 0.398 0 N-CA-C 115.695 1.038 . . . . 56.82 115.695 176.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 21.5 mt -94.44 119.14 41.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 CA-C-N 118.621 1.21 . . . . 47.94 108.755 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -106.35 112.36 25.34 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 107.912 -1.144 . . . . 64.05 107.912 -172.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 90.4 mt -89.36 138.11 19.94 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.086 0.47 . . . . 36.12 109.841 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 48.2 t -106.37 136.43 46.13 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.24 1.016 . . . . 44.37 109.764 170.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 78.5 t -100.2 99.82 9.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 106.381 -1.711 . . . . 37.03 106.381 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.94 27.07 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.489 0.551 . . . . 38.37 112.489 -172.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 54.2 mm-40 -137.69 137.09 38.01 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.875 -0.787 . . . . 56.17 108.875 -177.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.81 -104.13 1.84 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.268 -1.133 . . . . 31.45 110.268 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -97.54 137.22 36.81 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.593 -0.892 . . . . 33.78 108.593 -179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 68.7 mtm-85 -122.06 132.84 54.71 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.722 -0.844 . . . . 37.83 108.722 175.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 84.0 p -74.04 175.19 7.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.806 -1.158 . . . . 39.74 110.038 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -64.13 -41.59 97.15 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-N 114.798 -1.092 . . . . 34.84 110.345 -178.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.46 -46.58 69.42 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.429 -0.17 . . . . 34.45 111.43 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -58.82 -37.51 76.58 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.214 -0.594 . . . . 65.76 111.457 178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 tp60 -66.73 -42.97 85.43 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.703 -0.399 . . . . 30.87 111.345 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -64.42 -27.06 68.74 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.675 -0.81 . . . . 31.78 111.423 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.82 -44.27 73.83 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.478 -0.889 . . . . 37.93 111.111 174.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 12.4 mt -60.55 -44.81 95.71 Favored 'General case' 0 C--O 1.238 0.48 0 C-N-CA 120.194 -0.602 . . . . 34.87 111.272 175.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -61.4 -36.33 79.97 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.983 -0.287 . . . . 32.05 111.101 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.27 -29.12 69.66 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 112.396 0.517 . . . . 34.35 112.396 178.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -67.19 122.08 17.06 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.522 -0.547 . . . . 66.15 109.522 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.72 5.28 89.46 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-O 118.98 -0.9 . . . . 37.41 114.919 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -124.0 -61.49 1.36 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-N 118.461 1.131 . . . . 34.5 111.641 -179.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 27.1 p -113.21 10.22 18.54 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.348 0.522 . . . . 33.87 111.936 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -160.72 156.36 21.78 Favored Pre-proline 0 C--O 1.24 0.598 0 N-CA-C 108.332 -0.988 . . . . 40.24 108.332 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -58.61 161.07 15.54 Favored 'Trans proline' 0 C--O 1.233 0.233 0 CA-C-O 122.054 0.773 . . . . 51.25 112.127 -173.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 121.33 -176.08 16.26 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-O 122.312 0.951 . . . . 50.49 112.23 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 43.5 t -101.9 143.75 31.39 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-N 114.07 -1.065 . . . . 62.25 110.086 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 45.1 mm -64.12 111.81 1.2 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.53 0 CA-C-N 115.892 -0.595 . . . . 45.5 109.833 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 17.7 m -102.88 -29.59 2.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 C-N-CA 122.395 0.278 . . . . 42.79 111.425 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.3 t -141.27 163.81 31.95 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.611 0.72 . . . . 41.67 110.301 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -117.6 7.98 12.75 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 113.395 0.887 . . . . 65.53 113.395 171.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.71 130.64 54.92 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-N 118.412 0.551 . . . . 35.46 110.777 -177.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.4 mtt85 -70.7 165.93 21.93 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.651 0.739 . . . . 76.04 110.028 163.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -49.76 130.2 26.75 Favored Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.229 -0.896 . . . . 27.4 111.635 170.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.469 ' H ' ' ND2' ' A' ' 81' ' ' ASN . . . 91.47 -16.56 58.74 Favored Glycine 0 N--CA 1.44 -1.052 0 CA-C-O 119.086 -0.841 . . . . 31.61 114.638 -174.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -103.84 0.39 30.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 118.399 1.099 . . . . 44.55 113.832 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . 0.511 ' H ' ' ND2' ' A' ' 81' ' ' ASN . 12.2 t -105.01 143.87 32.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 118.874 0.761 . . . . 27.4 110.364 174.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 55.4 m-20 -70.82 -16.5 62.73 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.465 -0.894 . . . . 30.23 112.01 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -64.62 -19.73 65.86 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.701 0.63 . . . . 35.78 112.701 166.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.511 ' ND2' ' H ' ' A' ' 78' ' ' SER . 64.5 m-20 -75.16 -6.13 47.99 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.666 -1.214 . . . . 32.13 112.249 179.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -120.87 5.27 10.46 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 113.146 0.795 . . . . 33.07 113.146 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.23 21.27 79.85 Favored Glycine 0 C--N 1.335 0.504 0 N-CA-C 114.984 0.754 . . . . 28.42 114.984 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.467 HG12 ' HD3' ' A' ' 22' ' ' ARG . 22.0 m -108.07 4.44 9.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 118.109 0.955 . . . . 26.44 112.494 -177.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -134.16 144.97 48.83 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 118.691 0.678 . . . . 24.18 110.541 -171.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.3 m -130.77 151.23 35.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.329 0 CA-C-O 121.911 0.862 . . . . 29.57 109.677 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HA ' ' O ' ' A' ' 131' ' ' PRO . 91.2 m-20 -110.73 119.96 40.85 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.088 -0.96 . . . . 35.76 109.151 171.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 51.3 mt -111.7 133.94 53.6 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.453 1.101 . . . . 40.35 110.749 -177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 8.6 p -125.33 -173.88 2.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.378 -0.971 . . . . 43.16 108.378 161.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.6 mt -107.94 155.28 20.49 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.59 0.709 . . . . 46.31 110.755 179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -95.47 146.85 24.12 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.994 -1.003 . . . . 52.21 109.225 172.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . 0.474 HG23 ' O ' ' A' ' 97' ' ' ASP . 31.3 p -58.26 158.58 7.0 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 119.56 -0.856 . . . . 65.28 109.686 165.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -59.47 -15.43 17.48 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.749 -0.659 . . . . 76.89 112.456 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 40.6 p-10 -112.89 -1.53 14.56 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 113.717 1.006 . . . . 72.25 113.717 178.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 78.95 15.35 80.78 Favored Glycine 0 C--N 1.334 0.445 0 N-CA-C 116.23 1.252 . . . . 63.06 116.23 177.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.8 p -88.13 -18.42 28.85 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 118.433 1.117 . . . . 64.77 113.221 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 92' ' ' THR . 31.1 t70 -152.74 164.74 37.19 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.658 -0.868 . . . . 81.36 108.658 -175.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 22.4 m -113.64 159.61 13.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 122.155 0.979 . . . . 65.54 109.052 175.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.7 pt -134.86 131.24 53.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 107.882 -1.155 . . . . 55.57 107.882 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 66.0 m95 -100.1 104.96 16.55 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 106.223 -1.769 . . . . 52.79 106.223 177.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.6 t -151.74 147.52 26.79 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 107.347 -1.353 . . . . 65.21 107.347 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.537 HG11 ' CD2' ' A' ' 130' ' ' TYR . 18.6 m -102.17 8.0 9.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.515 -0.766 . . . . 52.71 111.198 174.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -96.75 148.84 22.48 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.715 1.206 . . . . 82.99 111.199 -172.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.53 -105.37 1.13 Allowed Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.702 -1.135 . . . . 66.82 114.161 168.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -67.66 -32.74 73.62 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.591 -0.844 . . . . 60.0 111.848 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -65.23 -14.24 60.22 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.763 -0.775 . . . . 58.83 112.672 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.472 ' NH1' 'CL ' ' A' ' 303' ' ' ' CL' . 7.4 mmm180 -80.59 -19.74 44.87 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 118.442 0.565 . . . . 92.01 111.96 176.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -75.02 -36.79 61.91 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 119.662 -0.815 . . . . 66.08 111.211 167.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 81.6 t -57.98 -47.95 85.32 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 CA-C-O 121.182 0.515 . . . . 37.75 110.792 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 13.6 mt -61.41 -40.15 85.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 C-N-CA 120.15 -0.62 . . . . 45.23 110.279 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.45 -39.35 93.11 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.301 -0.56 . . . . 36.18 110.945 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -75.34 -38.55 60.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 120.127 -0.629 . . . . 33.02 111.036 -177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 84.6 mmm -65.42 -41.14 93.9 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 120.445 -0.502 . . . . 36.59 110.83 -179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -63.04 -36.97 85.34 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.676 -0.81 . . . . 40.33 110.398 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -64.0 -30.58 71.64 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.331 -0.548 . . . . 38.63 111.479 -178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -78.27 -7.05 56.74 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 113.378 0.881 . . . . 41.82 113.378 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 110.88 0.55 28.74 Favored Glycine 0 C--O 1.238 0.391 0 CA-C-O 118.875 -0.959 . . . . 40.59 115.372 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -74.8 154.78 38.16 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.79 1.295 . . . . 37.53 110.415 -179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -101.23 142.69 32.3 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.831 -1.174 . . . . 74.82 107.831 164.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -99.55 134.69 42.07 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.746 -0.381 . . . . 49.96 110.247 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -73.4 -6.57 70.61 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.312 -0.715 . . . . 51.56 114.818 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -79.63 -6.09 89.13 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 118.013 0.907 . . . . 52.91 114.503 168.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -94.76 -9.11 35.64 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 118.122 0.961 . . . . 59.05 113.42 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TRP . . . . . 0.435 ' HB2' ' H ' ' A' ' 128' ' ' LYS . 10.5 m0 -71.36 139.96 50.01 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.348 -0.612 . . . . 63.72 109.348 167.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 13.9 m -91.03 -40.01 12.25 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 119.205 -0.998 . . . . 68.56 110.984 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 44.2 t -93.01 -30.11 15.49 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.317 -0.864 . . . . 75.72 112.754 -175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -83.45 -75.79 0.31 Allowed 'General case' 0 C--O 1.239 0.549 0 N-CA-C 109.572 -0.529 . . . . 92.92 109.572 172.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.548 ' HD3' ' OH ' ' A' ' 130' ' ' TYR . 14.1 ttmm 64.58 92.16 0.07 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.91 0.884 . . . . 73.51 111.025 176.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -124.03 97.07 5.18 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.134 1.774 . . . . 64.9 106.45 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.548 ' OH ' ' HD3' ' A' ' 128' ' ' LYS . 38.0 m-85 -72.19 -39.71 6.78 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 115.097 1.517 . . . . 95.45 115.097 -160.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' PRO . . . . . 0.459 ' O ' ' HA ' ' A' ' 87' ' ' ASP . 85.7 Cg_endo -80.63 12.05 2.72 Favored 'Trans proline' 0 C--O 1.232 0.187 0 N-CA-C 115.133 1.166 . . . . 37.26 115.133 177.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HIS . . . . . 0.444 ' HE2' ' HG3' ' A' ' 134' ' ' GLU . 51.5 t60 -114.22 129.59 56.63 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 119.716 1.144 . . . . 33.46 111.118 -158.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -130.58 141.24 50.45 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.597 0.56 . . . . 34.67 110.011 175.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.444 ' HG3' ' HE2' ' A' ' 132' ' ' HIS . 82.7 mt-10 -125.57 128.93 48.7 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 125.5 1.52 . . . . 44.41 110.983 -178.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 13.1 tp -82.35 -33.69 28.77 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.337 -0.945 . . . . 35.44 111.934 170.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -135.78 149.54 49.16 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.405 -0.961 . . . . 42.01 108.405 174.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -97.76 72.29 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.329 1.061 . . . . 45.65 109.344 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 73.2 t -57.89 -39.16 70.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-N 114.415 -1.266 . . . . 39.76 110.946 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 3.6 t -71.25 -35.67 58.92 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 119.783 -0.767 . . . . 41.81 110.735 -175.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -75.49 7.17 26.72 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 115.739 1.056 . . . . 49.64 115.739 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 99.0 3.05 56.99 Favored Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 117.003 1.561 . . . . 62.26 117.003 176.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -74.92 137.98 42.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 118.9 1.35 . . . . 56.9 110.285 173.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mttt -104.58 117.38 59.17 Favored Pre-proline 0 C--O 1.239 0.538 0 N-CA-C 109.346 -0.613 . . . . 81.84 109.346 173.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -68.25 150.85 76.88 Favored 'Trans proline' 0 C--O 1.241 0.657 0 CA-C-N 119.343 0.801 . . . . 50.98 110.673 177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -66.54 167.0 20.04 Favored 'Trans proline' 0 C--O 1.235 0.337 0 N-CA-C 109.765 -0.898 . . . . 56.02 109.765 167.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -57.06 145.45 30.7 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.279 -0.969 . . . . 62.51 109.25 175.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.407 ' OD2' ' HG2' ' A' ' 23' ' ' LYS . 37.3 t0 -71.03 102.37 2.42 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.402 -0.817 . . . . 60.64 109.725 -170.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -95.03 -28.54 15.07 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 112.391 0.515 . . . . 87.94 112.391 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 94.46 -161.68 24.19 Favored Glycine 0 N--CA 1.448 -0.543 0 CA-C-O 122.234 0.908 . . . . 69.5 112.217 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 84.49 145.8 7.35 Favored Glycine 0 C--N 1.337 0.603 0 N-CA-C 116.617 1.407 . . . . 68.72 116.617 170.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . 0.516 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . . . -90.39 -152.95 0.28 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.194 0.598 . . . . 76.43 111.263 178.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.5 t . . . . . 0 N--CA 1.467 0.395 0 CA-C-O 121.012 0.434 . . . . 72.19 111.056 -177.216 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' ' CL' . . . . . 0.472 'CL ' ' NH1' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_