data_6ntc_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 6ntc _Structure_validation_residue.Date_analyzed 2020-02-28 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 ' -1' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.304 0.853 . . . . 211.21 113.304 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -89.74 28.88 0.43 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 CA-C-N 118.947 0.66 . . . . 208.98 112.427 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm -120.13 132.41 55.4 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.41 -0.589 . . . . 190.66 109.41 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -107.64 142.34 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.074 0.55 . . . . 158.56 109.772 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -106.51 122.95 47.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.251 -0.648 . . . . 136.25 109.251 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -116.17 117.68 30.73 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.874 -0.787 . . . . 144.96 108.874 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -91.98 113.37 25.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.515 -0.92 . . . . 126.86 108.515 177.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . 0.516 ' N ' ' O ' ' A' ' 54' ' ' ASP . 19.9 mt -112.09 144.21 41.84 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.658 0.383 . . . . 115.35 110.121 -174.229 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.78 137.36 58.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.46 -0.941 . . . . 124.69 108.46 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.7 t -114.33 120.05 63.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.041 -1.096 . . . . 117.4 108.041 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.58 156.09 37.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.795 0.807 . . . . 115.88 109.29 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . 0.411 ' O ' ' OH ' ' A' ' 96' ' ' TYR . . . 166.89 -164.92 38.17 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.501 -1.039 . . . . 149.97 110.501 -178.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . 0.483 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . -73.07 -165.18 0.21 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.19 -0.505 . . . . 142.38 111.909 178.781 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . 0.509 ' O ' ' N3B' ' A' ' 201' ' ' GNP . 2.7 t -85.47 -48.24 16.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.823 0.344 . . . . 188.09 111.348 -177.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -111.49 72.15 0.21 Allowed Glycine 0 N--CA 1.449 -0.46 0 O-C-N 121.553 -0.717 . . . . 162.27 113.497 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 m -121.72 -40.23 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 122.672 0.389 . . . . 124.96 111.881 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.03 29.29 0.95 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.195 -0.526 . . . . 102.66 113.664 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 0.483 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 36.1 mtmm -60.97 -34.81 75.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.09 -0.644 . . . . 120.9 110.861 176.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 m -84.95 -42.63 14.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.73 -0.388 . . . . 154.09 111.413 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.72 92.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.184 -0.606 . . . . 126.69 111.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.7 mt -64.1 -45.95 86.36 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.409 -0.516 . . . . 106.91 110.969 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.5 m -68.54 -42.61 78.18 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.214 -0.594 . . . . 135.03 111.281 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . . . -67.3 -38.16 80.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.164 -0.614 . . . . 130.61 110.59 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -63.41 -32.53 74.0 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.898 -0.501 . . . . 163.86 111.478 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.9 tp -72.86 -36.24 67.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.459 -0.496 . . . . 132.79 111.535 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.7 mp -86.28 -48.45 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.129 -0.357 . . . . 126.9 111.647 -171.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -109.59 -0.45 18.7 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.721 1.008 . . . . 207.46 113.721 -174.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.8 m120 59.01 39.67 23.19 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.098 0.559 . . . . 164.62 111.874 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -148.99 137.01 20.74 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.73 -0.841 . . . . 169.51 108.73 173.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -89.25 131.0 35.56 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.803 -0.635 . . . . 160.95 110.127 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.63 107.64 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 107.888 -1.152 . . . . 165.79 107.888 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . . . -69.02 -36.73 78.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.112 -0.635 . . . . 165.98 111.231 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -72.96 -179.6 3.28 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 122.037 0.923 . . . . 173.41 110.022 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.08 102.75 5.11 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.88 -0.785 . . . . 216.99 108.88 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -109.18 103.72 53.18 Favored Pre-proline 0 C--O 1.241 0.643 0 N-CA-C 107.696 -1.224 . . . . 185.81 107.696 169.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -59.99 127.93 24.94 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 CA-C-N 119.073 0.705 . . . . 213.35 111.595 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . 0.417 ' N ' ' O1G' ' A' ' 201' ' ' GNP . 8.1 p -81.61 135.12 35.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 178.99 110.935 -177.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . . . -79.45 -71.62 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.193 -1.039 . . . . 165.8 108.193 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -151.47 128.5 11.08 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.284 -1.006 . . . . 177.28 108.284 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . 0.559 ' OD2' ' NH1' ' B' ' 88' ' ' ARG . 77.5 m-20 -137.28 137.7 39.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.536 -0.542 . . . . 171.6 109.536 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 t -126.0 125.74 43.17 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.055 -0.72 . . . . 151.3 109.055 177.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -123.3 165.65 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.625 0.726 . . . . 148.85 109.683 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -141.04 141.08 34.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.351 -0.84 . . . . 170.36 109.351 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . . . -151.75 132.65 14.19 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.249 -0.649 . . . . 150.49 109.249 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -96.83 122.04 39.36 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.927 -0.768 . . . . 152.08 108.927 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -132.26 170.43 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.765 0.793 . . . . 138.08 109.007 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 75.2 t -115.76 106.3 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.098 -1.445 . . . . 138.83 107.098 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.1 mt -106.51 122.74 60.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 N-CA-C 107.602 -1.259 . . . . 125.21 107.602 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . 0.666 ' OD2' ' NH2' ' A' ' 164' ' ' ARG . 64.5 m-20 55.38 -102.08 0.14 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.102 -0.499 . . . . 152.44 110.42 -172.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.75 2.95 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.607 -0.806 . . . . 127.9 114.959 -175.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -93.38 156.68 16.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.015 0.912 . . . . 196.9 111.829 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.2 m -88.95 131.76 35.01 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.899 -1.046 . . . . 158.25 108.49 172.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 35.5 m -128.32 134.19 48.85 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 110.107 -0.331 . . . . 131.39 110.107 -171.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -100.58 121.73 42.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.069 -1.086 . . . . 143.39 108.069 172.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.1 mt -112.19 111.08 21.72 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.556 -0.535 . . . . 143.46 109.556 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' A' ' 6' ' ' LEU . . . -88.15 122.34 31.59 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.243 -1.021 . . . . 143.66 108.243 169.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.0 mt -120.95 137.8 53.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.95 -0.759 . . . . 121.87 108.95 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.11 120.98 39.4 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.392 -0.596 . . . . 139.41 109.392 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -97.9 102.84 14.7 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.417 -1.327 . . . . 156.57 107.417 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.8 p -82.36 174.62 10.95 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.936 0.874 . . . . 142.87 110.236 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -101.94 131.25 48.44 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.209 -0.663 . . . . 180.17 109.209 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.12 -28.04 70.93 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.059 -1.067 . . . . 189.15 113.22 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . . . -63.47 131.22 47.47 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.334 0.567 . . . . 236.79 110.729 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . . . -70.76 -23.83 62.49 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.508 0.558 . . . . 254.07 112.508 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -62.87 -32.83 74.16 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.301 -0.56 . . . . 266.59 111.384 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . . . -98.2 -12.42 21.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.774 0.657 . . . . 263.95 112.774 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . . . -88.03 17.28 5.1 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.486 0.55 . . . . 262.1 112.486 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.75 93.75 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.262 -0.575 . . . . 251.86 110.729 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . . . -84.74 38.31 0.69 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 217.66 112.147 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . -70.34 -24.2 62.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.098 0.407 . . . . 207.28 112.098 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . . . -64.13 -32.5 74.09 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.328 -0.549 . . . . 195.26 111.578 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . . . -68.86 -47.81 65.01 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.723 -0.391 . . . . 183.78 111.26 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . . . -61.47 -38.22 86.46 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.739 -0.384 . . . . 178.68 111.248 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 42.9 mtt -75.07 -33.49 61.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.631 -0.428 . . . . 197.99 111.711 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -66.86 -10.83 52.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.6 0.963 . . . . 195.57 113.6 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.6 m -112.04 -37.01 5.2 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 113.449 0.907 . . . . 153.87 113.449 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.85 150.78 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.472 -0.87 . . . . 152.54 112.731 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -107.53 -4.52 18.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.318 0.858 . . . . 140.17 113.318 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -152.28 151.67 23.5 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 109.877 -1.289 . . . . 120.29 109.877 176.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -135.45 129.1 32.68 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.805 -0.358 . . . . 124.85 111.014 -171.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mt -100.15 112.57 24.88 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.731 -1.211 . . . . 110.35 107.731 169.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 61.9 m -96.83 112.2 24.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.874 -1.158 . . . . 125.33 107.874 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 50.4 t -110.41 133.18 56.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.136 -0.69 . . . . 130.84 109.136 -168.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -130.15 152.36 49.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.293 -1.002 . . . . 133.86 108.293 166.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.63 130.56 34.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 113.57 109.65 171.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.9 pt -69.44 -3.86 3.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 115.931 -0.577 . . . . 129.21 112.317 178.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -108.97 23.4 14.61 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.827 0.74 . . . . 141.74 111.822 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -137.84 96.74 3.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.723 -1.584 . . . . 136.94 106.723 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.3 m -62.6 -39.04 92.5 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.531 -0.468 . . . . 124.15 111.029 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -62.26 -43.84 97.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.689 -0.404 . . . . 161.19 111.282 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.5 p -60.05 -35.59 75.46 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.389 -0.524 . . . . 112.9 111.142 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -70.14 -40.4 74.83 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.402 -0.519 . . . . 123.29 111.147 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -66.85 -25.95 66.67 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.529 -0.468 . . . . 138.46 111.647 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -80.71 -5.95 57.76 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.137 0.792 . . . . 195.89 113.137 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.3 mm -64.44 -35.49 74.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 118.607 0.64 . . . . 123.06 110.386 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -55.38 -43.33 75.07 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 122.033 -0.417 . . . . 171.16 111.182 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -60.7 -49.62 76.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.688 -0.405 . . . . 196.49 111.159 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' TYR . . . . . 0.411 ' OH ' ' O ' ' A' ' 10' ' ' GLY . 48.9 m-85 -60.13 -46.86 88.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.978 -0.289 . . . . 139.94 111.317 -176.52 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -59.86 -38.28 81.69 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.577 -0.449 . . . . 174.25 111.265 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -63.38 -46.6 85.74 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.179 -0.609 . . . . 188.27 110.704 175.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . . . -61.68 -34.38 75.64 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.657 -0.417 . . . . 135.09 111.599 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 51.8 mm -72.0 -50.66 35.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.353 -0.539 . . . . 142.34 110.225 176.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . . . -64.33 -18.63 64.81 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.262 0.467 . . . . 140.31 112.262 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -83.09 -54.76 4.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.105 0.411 . . . . 168.25 111.088 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.0 t -63.57 -32.67 57.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 120.913 -0.315 . . . . 189.25 111.056 -174.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -91.79 -12.62 33.28 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.028 0.751 . . . . 184.26 113.028 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.9 t0 49.27 70.66 0.45 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 122.37 1.081 . . . . 203.96 110.772 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.8 t -165.66 141.65 5.19 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.013 -1.449 . . . . 189.39 108.85 -179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . . . -83.23 -12.37 56.87 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.594 -0.73 . . . . 186.18 112.513 169.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -124.57 107.36 10.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.195 -1.039 . . . . 189.36 108.195 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.7 136.06 28.49 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 107.98 -1.118 . . . . 148.97 107.98 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -58.05 104.88 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.345 0 CA-C-N 119.097 0.713 . . . . 129.38 112.781 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 59.6 mtm -140.07 158.71 43.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.527 0.679 . . . . 127.39 109.415 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 32.9 t -140.1 127.64 24.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.124 -1.065 . . . . 106.88 108.124 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.4 tp -83.66 126.75 33.18 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.17 -0.678 . . . . 104.62 109.17 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 14.4 t -123.63 121.06 61.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.972 -0.751 . . . . 101.03 108.972 -175.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.43 106.41 3.4 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 111.034 -0.826 . . . . 102.51 111.034 171.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -90.16 171.27 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.821 0.82 . . . . 107.92 111.014 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 61.26 42.71 11.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.17 -0.923 . . . . 145.26 111.527 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 5.3 p -82.8 8.31 12.66 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.74 0.645 . . . . 135.55 112.74 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 119' ' ' ASP . 13.0 p-10 -84.68 -8.24 58.93 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.84 0.681 . . . . 158.99 112.84 173.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 24.8 mt -94.93 169.95 9.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.954 0.883 . . . . 154.74 110.657 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -107.87 172.0 7.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.349 -0.841 . . . . 151.37 109.604 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 60.14 49.39 7.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.208 -0.906 . . . . 191.62 111.263 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -66.31 130.8 44.44 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.898 -0.592 . . . . 152.82 110.333 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.9 p -76.87 -22.9 52.78 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.904 -0.589 . . . . 148.63 112.501 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 59.9 t -111.76 118.67 58.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.995 -1.113 . . . . 138.55 107.995 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -76.43 160.06 29.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.702 0.763 . . . . 180.35 110.087 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.5 t -63.91 -42.37 97.43 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.443 -0.799 . . . . 122.72 111.056 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . . . -57.09 -33.83 67.69 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.869 0.322 . . . . 130.89 111.869 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -64.7 -54.92 23.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.485 -0.486 . . . . 156.15 110.647 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.02 -26.63 68.94 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.665 -0.414 . . . . 117.68 111.747 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -63.18 -49.68 73.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.738 -0.385 . . . . 133.82 111.004 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -64.46 -36.66 84.89 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.745 -0.382 . . . . 155.48 111.452 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . 0.42 ' O ' ' OG ' ' A' ' 136' ' ' SER . 34.1 tp -63.63 -47.83 79.78 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.316 -0.553 . . . . 114.93 110.937 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.06 79.54 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.369 -0.532 . . . . 131.47 110.99 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 ttm-85 -63.62 -33.7 76.2 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.564 -0.454 . . . . 170.1 111.343 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 133' ' ' LEU . 95.2 p -70.16 -38.97 75.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.443 -0.503 . . . . 130.73 111.139 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -78.28 -16.99 57.22 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.784 0.661 . . . . 141.99 112.784 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 78.34 26.56 59.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.565 -0.826 . . . . 120.1 113.953 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 25.7 pt -122.55 160.88 46.54 Favored Pre-proline 0 C--O 1.245 0.816 0 N-CA-C 107.651 -1.24 . . . . 114.44 107.651 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.01 160.63 13.71 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 120.648 0.899 . . . . 99.97 112.48 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -120.54 131.7 54.81 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.513 -1.221 . . . . 111.66 109.201 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.4 133.81 49.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.512 -0.921 . . . . 110.5 108.512 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.07 132.35 40.05 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.836 -0.431 . . . . 112.74 109.836 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 37.4 p -128.83 165.37 21.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.928 0.87 . . . . 110.09 110.451 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 23.2 t -147.35 111.97 5.31 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.255 -1.387 . . . . 114.93 107.255 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.53 -32.72 74.26 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.078 -0.649 . . . . 129.49 111.579 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . . . -71.47 -47.19 57.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.52 -0.472 . . . . 126.67 111.031 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 1.6 m -77.65 -15.64 59.06 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.753 0.649 . . . . 163.94 112.753 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.8 ttt85 59.44 23.39 11.96 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.817 0.847 . . . . 140.11 111.638 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -77.84 123.46 26.76 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.519 -0.549 . . . . 182.41 109.519 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 61.99 11.03 29.53 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 115.007 0.763 . . . . 117.36 115.007 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 48.9 t -66.89 -46.92 84.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 117.287 0.544 . . . . 124.37 110.441 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.96 -44.89 91.41 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.854 -0.528 . . . . 187.49 110.937 174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -57.04 -39.08 74.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.958 -0.297 . . . . 151.96 111.215 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -65.32 -54.57 27.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.876 0.37 . . . . 120.33 111.358 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.9 -44.9 94.85 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.184 -0.322 . . . . 118.06 111.369 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -67.42 -34.54 77.44 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.312 -0.555 . . . . 136.28 111.296 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -65.1 -34.06 77.52 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.076 -0.649 . . . . 107.74 111.11 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.04 -43.71 82.05 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.299 -0.561 . . . . 109.74 110.94 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.09 -41.61 87.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-O 121.0 0.429 . . . . 106.33 110.137 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt85 -63.67 -35.18 79.71 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.334 -0.547 . . . . 113.82 111.121 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -66.14 -36.92 84.39 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.069 -0.653 . . . . 117.91 111.083 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ILE . . . . . . . . . . . . . 28.6 mt -68.68 -51.03 49.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 121.222 0.534 . . . . 117.28 110.217 173.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ARG . . . . . 0.666 ' NH2' ' OD2' ' A' ' 47' ' ' ASP . 7.9 tmm_? -63.08 -29.27 70.68 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.153 -0.342 . . . . 129.22 111.811 -175.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -90.88 8.91 32.58 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.057 0.762 . . . . 122.1 113.057 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 3.4 t60 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 118.376 0.535 . . . . 163.27 110.936 179.942 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 48.6 t30 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.508 0.194 . . . . 207.79 110.506 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . . . -156.46 148.04 22.64 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.454 -0.572 . . . . 188.12 109.454 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . . . -142.09 128.04 18.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 108.28 -1.007 . . . . 162.27 108.28 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . . . -99.18 144.57 28.15 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.902 0.481 . . . . 186.68 110.056 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . . . -139.59 149.38 22.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.061 -0.718 . . . . 162.43 109.061 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LEU . . . . . . . . . . . . . . . -95.7 157.11 16.04 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.696 0.76 . . . . 145.56 110.896 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . 0.445 ' N ' ' O ' ' B' ' 66' ' ' GLU . . . -131.55 168.72 16.19 Favored Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 124.213 1.005 . . . . 178.41 108.926 -176.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -66.71 167.0 20.38 Favored 'Trans proline' 0 C--O 1.233 0.244 0 CA-C-O 122.322 0.884 . . . . 158.99 111.784 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 61.5 35.39 17.54 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.537 -1.211 . . . . 180.61 111.504 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . . . 57.21 42.0 26.06 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.48 0.657 . . . . 174.06 110.985 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' B' ' 62' ' ' LEU . 86.2 mt-10 -116.73 166.12 12.5 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.899 0.88 . . . . 179.5 108.906 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 12.5 p-90 -165.95 -179.01 4.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.771 -0.826 . . . . 163.55 108.771 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -173.38 144.02 1.13 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.793 1.237 . . . . 175.2 109.096 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 6.5 t -119.27 136.65 55.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.999 -0.741 . . . . 186.91 108.999 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.2 t -138.5 152.16 24.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 108.739 -0.837 . . . . 191.2 108.739 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . . . -94.99 164.85 12.72 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.621 0.724 . . . . 180.39 111.072 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' VAL . . . . . . . . . . . . . 1.6 p . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 115.377 -0.829 . . . . 195.2 111.553 -177.919 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' MET . . . . . 0.516 ' O ' ' N ' ' B' ' 118' ' ' ALA . . . . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.588 0.232 . . . . 234.63 111.111 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 40.8 t -64.02 126.27 27.15 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.319 -0.4 . . . . 282.81 110.546 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . . . -60.45 -31.7 70.68 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.957 -0.565 . . . . 206.4 111.386 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -70.55 -36.53 73.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.128 -0.629 . . . . 217.7 111.028 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . . . -76.22 -28.23 57.11 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.107 0.41 . . . . 243.75 112.107 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 40.7 t -76.34 -32.84 58.9 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.439 -0.504 . . . . 226.27 111.877 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 69.6 mt -104.96 16.85 25.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.533 0.568 . . . . 176.23 112.533 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . . . -70.63 -53.2 16.79 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.579 -0.448 . . . . 204.19 111.331 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -64.98 -40.99 95.79 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.446 -0.502 . . . . 179.65 111.471 -175.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.69 -35.68 77.5 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.327 -0.549 . . . . 186.8 111.426 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . . . -63.57 -44.16 94.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.477 -0.489 . . . . 148.58 110.927 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . . . -67.99 -36.6 80.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.281 -0.568 . . . . 174.94 111.036 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . 0.559 ' NH1' ' OD2' ' A' ' 38' ' ' ASP . 27.5 mtm105 -59.75 -50.85 72.24 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.626 -0.43 . . . . 194.93 110.863 174.382 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -75.7 -9.79 58.89 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.629 0.603 . . . . 165.47 112.629 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.39 74.23 1.27 Allowed Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 118.272 0.487 . . . . 228.2 113.321 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . . . -161.66 134.22 5.97 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.963 -0.754 . . . . 208.59 108.963 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . . . -92.23 128.08 46.52 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 109.444 -0.576 . . . . 237.49 109.444 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -67.86 -11.12 31.04 Favored 'Trans proline' 0 C--O 1.237 0.467 0 N-CA-C 114.145 0.787 . . . . 260.01 114.145 -174.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . . . -80.84 -35.78 32.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.074 0.852 . . . . 260.36 111.338 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 26.8 t -78.13 -3.49 42.68 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.178 0.807 . . . . 231.69 113.178 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 20.1 m -143.88 166.87 23.71 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.585 0.707 . . . . 229.05 109.418 -176.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.49 161.09 42.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.901 -0.777 . . . . 236.25 108.901 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . . . -74.79 172.57 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 115.461 -0.79 . . . . 269.7 110.478 -173.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 267.05 110.091 175.115 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 213.5 111.116 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -138.66 119.96 14.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.879 -0.786 . . . . 257.98 108.879 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -76.57 142.55 40.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.161 0.505 . . . . 278.93 111.208 -175.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . . . -115.52 171.98 7.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.597 0.713 . . . . 258.97 109.492 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -76.15 153.64 36.05 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.491 -0.777 . . . . 292.6 110.927 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . . . -71.23 -31.17 67.23 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.49 -0.777 . . . . 218.23 111.799 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . . . -82.56 7.7 13.84 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.938 0.718 . . . . 208.97 112.938 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.0 m -67.37 145.75 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.499 0.666 . . . . 215.62 110.566 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -58.75 132.36 53.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.493 -0.776 . . . . 223.35 110.231 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ALA . . . . . 0.516 ' N ' ' O ' ' B' ' 76' ' ' MET . . . -70.97 -41.52 70.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.036 -0.529 . . . . 218.42 111.278 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.28 -0.99 2.91 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.561 0.948 . . . . 192.42 113.561 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 22.5 m -75.52 -47.18 28.05 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.567 1.076 . . . . 227.87 111.199 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . . . -90.56 28.21 1.55 Allowed 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.74 0.645 . . . . 173.72 112.74 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.52 137.05 24.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.238 0.542 . . . . 204.68 109.736 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.28 -29.97 5.0 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-O 119.635 -0.536 . . . . 191.59 114.34 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . . . -92.3 136.41 33.22 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 117.773 0.786 . . . . 174.31 109.687 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . . . -99.8 137.26 38.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.936 -0.575 . . . . 193.43 110.101 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . . . -117.49 171.31 8.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.877 0.846 . . . . 182.34 110.21 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . . . -123.0 164.62 18.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.094 -0.957 . . . . 194.4 109.15 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' VAL . . . . . . . . . . . . . 11.9 t -143.01 131.24 19.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.209 -0.663 . . . . 193.94 109.209 -175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -137.97 169.55 17.59 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.534 -0.913 . . . . 229.87 108.534 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.765 -0.652 . . . . 200.95 111.347 -178.892 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' GNP . . . . . 0.509 ' N3B' ' O ' ' A' ' 12' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.304 0.853 . . . . 211.21 113.304 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -89.74 28.88 0.43 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 CA-C-N 118.947 0.66 . . . . 208.98 112.427 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm -120.13 132.41 55.4 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.41 -0.589 . . . . 190.66 109.41 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -107.64 142.34 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.074 0.55 . . . . 158.56 109.772 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -106.51 122.95 47.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.251 -0.648 . . . . 136.25 109.251 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -116.17 117.68 30.73 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.874 -0.787 . . . . 144.96 108.874 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -91.98 113.37 25.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.515 -0.92 . . . . 126.86 108.515 177.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -112.09 144.21 41.84 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.658 0.383 . . . . 115.35 110.121 -174.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.78 137.36 58.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.46 -0.941 . . . . 124.69 108.46 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.7 t -114.33 120.05 63.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.041 -1.096 . . . . 117.4 108.041 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.58 156.09 37.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.795 0.807 . . . . 115.88 109.29 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 166.89 -164.92 38.17 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.501 -1.039 . . . . 149.97 110.501 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . 0.483 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . -73.07 -165.18 0.21 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.19 -0.505 . . . . 142.38 111.909 178.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.509 ' O ' ' N3B' ' A' ' 201' ' ' GNP . 2.7 t -85.47 -48.24 16.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.823 0.344 . . . . 188.09 111.348 -177.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -111.49 72.15 0.21 Allowed Glycine 0 N--CA 1.449 -0.46 0 O-C-N 121.553 -0.717 . . . . 162.27 113.497 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 m -121.72 -40.23 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 122.672 0.389 . . . . 124.96 111.881 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.03 29.29 0.95 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.195 -0.526 . . . . 102.66 113.664 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 0.483 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 36.1 mtmm -60.97 -34.81 75.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.09 -0.644 . . . . 120.9 110.861 176.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 m -84.95 -42.63 14.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.73 -0.388 . . . . 154.09 111.413 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.72 92.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.184 -0.606 . . . . 126.69 111.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.7 mt -64.1 -45.95 86.36 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.409 -0.516 . . . . 106.91 110.969 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.5 m -68.54 -42.61 78.18 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.214 -0.594 . . . . 135.03 111.281 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . . . -67.3 -38.16 80.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.164 -0.614 . . . . 130.61 110.59 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -63.41 -32.53 74.0 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.898 -0.501 . . . . 163.86 111.478 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.9 tp -72.86 -36.24 67.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.459 -0.496 . . . . 132.79 111.535 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . 0.691 HG22 ' HG3' ' A' ' 25' ' ' GLN . 1.7 mp -86.28 -48.45 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.129 -0.357 . . . . 126.9 111.647 -171.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . 0.691 ' HG3' HG22 ' A' ' 24' ' ' ILE . 92.8 mt-30 -109.59 -0.45 18.7 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.721 1.008 . . . . 207.46 113.721 -174.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.8 m120 59.01 39.67 23.19 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.098 0.559 . . . . 164.62 111.874 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -148.99 137.01 20.74 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.73 -0.841 . . . . 169.51 108.73 173.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -89.25 131.0 35.56 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.803 -0.635 . . . . 160.95 110.127 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.63 107.64 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 107.888 -1.152 . . . . 165.79 107.888 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . . . -69.02 -36.73 78.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.112 -0.635 . . . . 165.98 111.231 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -72.96 -179.6 3.28 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 122.037 0.923 . . . . 173.41 110.022 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.08 102.75 5.11 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.88 -0.785 . . . . 216.99 108.88 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -109.18 103.72 53.18 Favored Pre-proline 0 C--O 1.241 0.643 0 N-CA-C 107.696 -1.224 . . . . 185.81 107.696 169.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -59.99 127.93 24.94 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 CA-C-N 119.073 0.705 . . . . 213.35 111.595 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.1 p -81.61 135.12 35.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 178.99 110.935 -177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . . . -79.45 -71.62 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.193 -1.039 . . . . 165.8 108.193 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -151.47 128.5 11.08 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.284 -1.006 . . . . 177.28 108.284 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . 0.557 ' OD2' ' NH1' ' B' ' 88' ' ' ARG . 77.5 m-20 -137.28 137.7 39.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.536 -0.542 . . . . 171.6 109.536 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 t -126.0 125.74 43.17 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.055 -0.72 . . . . 151.3 109.055 177.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -123.3 165.65 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.625 0.726 . . . . 148.85 109.683 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -141.04 141.08 34.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.351 -0.84 . . . . 170.36 109.351 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . . . -151.75 132.65 14.19 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.249 -0.649 . . . . 150.49 109.249 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -96.83 122.04 39.36 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.927 -0.768 . . . . 152.08 108.927 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -132.26 170.43 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.765 0.793 . . . . 138.08 109.007 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 75.2 t -115.76 106.3 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.098 -1.445 . . . . 138.83 107.098 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.1 mt -106.51 122.74 60.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 N-CA-C 107.602 -1.259 . . . . 125.21 107.602 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . 0.559 ' OD2' ' NH2' ' A' ' 164' ' ' ARG . 64.5 m-20 55.38 -102.08 0.14 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.102 -0.499 . . . . 152.44 110.42 -172.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.75 2.95 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.607 -0.806 . . . . 127.9 114.959 -175.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -93.38 156.68 16.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.015 0.912 . . . . 196.9 111.829 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.2 m -88.95 131.76 35.01 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.899 -1.046 . . . . 158.25 108.49 172.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 35.5 m -128.32 134.19 48.85 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 110.107 -0.331 . . . . 131.39 110.107 -171.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -100.58 121.73 42.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.069 -1.086 . . . . 143.39 108.069 172.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.1 mt -112.19 111.08 21.72 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.556 -0.535 . . . . 143.46 109.556 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . . . -88.15 122.34 31.59 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.243 -1.021 . . . . 143.66 108.243 169.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.0 mt -120.95 137.8 53.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.95 -0.759 . . . . 121.87 108.95 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.11 120.98 39.4 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.392 -0.596 . . . . 139.41 109.392 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -97.9 102.84 14.7 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.417 -1.327 . . . . 156.57 107.417 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.8 p -82.36 174.62 10.95 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.936 0.874 . . . . 142.87 110.236 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -101.94 131.25 48.44 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.209 -0.663 . . . . 180.17 109.209 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.12 -28.04 70.93 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.059 -1.067 . . . . 189.15 113.22 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . . . -63.47 131.22 47.47 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.334 0.567 . . . . 236.79 110.729 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . . . -70.76 -23.83 62.49 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.508 0.558 . . . . 254.07 112.508 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -62.87 -32.83 74.16 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.301 -0.56 . . . . 266.59 111.384 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . . . -98.2 -12.42 21.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.774 0.657 . . . . 263.95 112.774 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . . . -88.03 17.28 5.1 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.486 0.55 . . . . 262.1 112.486 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.75 93.75 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.262 -0.575 . . . . 251.86 110.729 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . . . -84.74 38.31 0.69 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 217.66 112.147 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . -70.34 -24.2 62.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.098 0.407 . . . . 207.28 112.098 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . . . -64.13 -32.5 74.09 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.328 -0.549 . . . . 195.26 111.578 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . . . -68.86 -47.81 65.01 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.723 -0.391 . . . . 183.78 111.26 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . . . -61.47 -38.22 86.46 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.739 -0.384 . . . . 178.68 111.248 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 42.9 mtt -75.07 -33.49 61.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.631 -0.428 . . . . 197.99 111.711 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -66.86 -10.83 52.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.6 0.963 . . . . 195.57 113.6 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.6 m -112.04 -37.01 5.2 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 113.449 0.907 . . . . 153.87 113.449 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.85 150.78 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.472 -0.87 . . . . 152.54 112.731 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -107.53 -4.52 18.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.318 0.858 . . . . 140.17 113.318 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . 0.583 ' HA3' HD11 ' A' ' 163' ' ' ILE . . . -152.28 151.67 23.5 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 109.877 -1.289 . . . . 120.29 109.877 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . 0.605 ' HB2' ' HG2' ' A' ' 111' ' ' MET . 97.6 m-85 -135.45 129.1 32.68 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.805 -0.358 . . . . 124.85 111.014 -171.552 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mt -100.15 112.57 24.88 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.731 -1.211 . . . . 110.35 107.731 169.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 61.9 m -96.83 112.2 24.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.874 -1.158 . . . . 125.33 107.874 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 50.4 t -110.41 133.18 56.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.136 -0.69 . . . . 130.84 109.136 -168.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -130.15 152.36 49.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.293 -1.002 . . . . 133.86 108.293 166.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.63 130.56 34.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 113.57 109.65 171.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.9 pt -69.44 -3.86 3.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 115.931 -0.577 . . . . 129.21 112.317 178.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -108.97 23.4 14.61 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.827 0.74 . . . . 141.74 111.822 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -137.84 96.74 3.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.723 -1.584 . . . . 136.94 106.723 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.3 m -62.6 -39.04 92.5 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.531 -0.468 . . . . 124.15 111.029 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -62.26 -43.84 97.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.689 -0.404 . . . . 161.19 111.282 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.5 p -60.05 -35.59 75.46 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.389 -0.524 . . . . 112.9 111.142 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -70.14 -40.4 74.83 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.402 -0.519 . . . . 123.29 111.147 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -66.85 -25.95 66.67 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.529 -0.468 . . . . 138.46 111.647 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -80.71 -5.95 57.76 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.137 0.792 . . . . 195.89 113.137 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.3 mm -64.44 -35.49 74.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 118.607 0.64 . . . . 123.06 110.386 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 t-80 -55.38 -43.33 75.07 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 122.033 -0.417 . . . . 171.16 111.182 177.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -60.7 -49.62 76.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.688 -0.405 . . . . 196.49 111.159 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' TYR . . . . . 0.458 ' O ' HG12 ' A' ' 100' ' ' ILE . 48.9 m-85 -60.13 -46.86 88.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.978 -0.289 . . . . 139.94 111.317 -176.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -59.86 -38.28 81.69 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.577 -0.449 . . . . 174.25 111.265 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 94' ' ' HIS . 74.0 mm-40 -63.38 -46.6 85.74 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.179 -0.609 . . . . 188.27 110.704 175.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . . . -61.68 -34.38 75.64 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.657 -0.417 . . . . 135.09 111.599 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 96' ' ' TYR . 51.8 mm -72.0 -50.66 35.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.353 -0.539 . . . . 142.34 110.225 176.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . . . -64.33 -18.63 64.81 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.262 0.467 . . . . 140.31 112.262 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -83.09 -54.76 4.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.105 0.411 . . . . 168.25 111.088 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.0 t -63.57 -32.67 57.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 120.913 -0.315 . . . . 189.25 111.056 -174.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -91.79 -12.62 33.28 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.028 0.751 . . . . 184.26 113.028 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.9 t0 49.27 70.66 0.45 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 122.37 1.081 . . . . 203.96 110.772 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.8 t -165.66 141.65 5.19 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.013 -1.449 . . . . 189.39 108.85 -179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . . . -83.23 -12.37 56.87 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.594 -0.73 . . . . 186.18 112.513 169.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -124.57 107.36 10.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.195 -1.039 . . . . 189.36 108.195 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.7 136.06 28.49 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 107.98 -1.118 . . . . 148.97 107.98 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -58.05 104.88 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.345 0 CA-C-N 119.097 0.713 . . . . 129.38 112.781 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 0.605 ' HG2' ' HB2' ' A' ' 78' ' ' PHE . 59.6 mtm -140.07 158.71 43.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.527 0.679 . . . . 127.39 109.415 179.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 32.9 t -140.1 127.64 24.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.124 -1.065 . . . . 106.88 108.124 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.4 tp -83.66 126.75 33.18 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.17 -0.678 . . . . 104.62 109.17 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 14.4 t -123.63 121.06 61.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.972 -0.751 . . . . 101.03 108.972 -175.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.43 106.41 3.4 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 111.034 -0.826 . . . . 102.51 111.034 171.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -90.16 171.27 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.821 0.82 . . . . 107.92 111.014 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 61.26 42.71 11.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.17 -0.923 . . . . 145.26 111.527 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 5.3 p -82.8 8.31 12.66 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.74 0.645 . . . . 135.55 112.74 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -84.68 -8.24 58.93 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.84 0.681 . . . . 158.99 112.84 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 24.8 mt -94.93 169.95 9.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.954 0.883 . . . . 154.74 110.657 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -107.87 172.0 7.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.349 -0.841 . . . . 151.37 109.604 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 60.14 49.39 7.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.208 -0.906 . . . . 191.62 111.263 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -66.31 130.8 44.44 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.898 -0.592 . . . . 152.82 110.333 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.9 p -76.87 -22.9 52.78 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.904 -0.589 . . . . 148.63 112.501 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 59.9 t -111.76 118.67 58.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.995 -1.113 . . . . 138.55 107.995 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -76.43 160.06 29.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.702 0.763 . . . . 180.35 110.087 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.5 t -63.91 -42.37 97.43 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.443 -0.799 . . . . 122.72 111.056 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . . . -57.09 -33.83 67.69 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.869 0.322 . . . . 130.89 111.869 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -64.7 -54.92 23.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.485 -0.486 . . . . 156.15 110.647 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.02 -26.63 68.94 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.665 -0.414 . . . . 117.68 111.747 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -63.18 -49.68 73.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.738 -0.385 . . . . 133.82 111.004 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -64.46 -36.66 84.89 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.745 -0.382 . . . . 155.48 111.452 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.63 -47.83 79.78 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.316 -0.553 . . . . 114.93 110.937 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.06 79.54 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.369 -0.532 . . . . 131.47 110.99 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 ttm-85 -63.62 -33.7 76.2 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.564 -0.454 . . . . 170.1 111.343 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 95.2 p -70.16 -38.97 75.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.443 -0.503 . . . . 130.73 111.139 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -78.28 -16.99 57.22 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.784 0.661 . . . . 141.99 112.784 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 78.34 26.56 59.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.565 -0.826 . . . . 120.1 113.953 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 25.7 pt -122.55 160.88 46.54 Favored Pre-proline 0 C--O 1.245 0.816 0 N-CA-C 107.651 -1.24 . . . . 114.44 107.651 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.01 160.63 13.71 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 120.648 0.899 . . . . 99.97 112.48 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -120.54 131.7 54.81 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.513 -1.221 . . . . 111.66 109.201 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.4 133.81 49.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.512 -0.921 . . . . 110.5 108.512 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.07 132.35 40.05 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.836 -0.431 . . . . 112.74 109.836 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 37.4 p -128.83 165.37 21.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.928 0.87 . . . . 110.09 110.451 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 23.2 t -147.35 111.97 5.31 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.255 -1.387 . . . . 114.93 107.255 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.53 -32.72 74.26 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.078 -0.649 . . . . 129.49 111.579 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . . . -71.47 -47.19 57.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.52 -0.472 . . . . 126.67 111.031 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 1.6 m -77.65 -15.64 59.06 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.753 0.649 . . . . 163.94 112.753 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.8 ttt85 59.44 23.39 11.96 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.817 0.847 . . . . 140.11 111.638 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -77.84 123.46 26.76 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.519 -0.549 . . . . 182.41 109.519 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 61.99 11.03 29.53 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 115.007 0.763 . . . . 117.36 115.007 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 48.9 t -66.89 -46.92 84.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 117.287 0.544 . . . . 124.37 110.441 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.96 -44.89 91.41 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.854 -0.528 . . . . 187.49 110.937 174.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -57.04 -39.08 74.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.958 -0.297 . . . . 151.96 111.215 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -65.32 -54.57 27.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.876 0.37 . . . . 120.33 111.358 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.9 -44.9 94.85 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.184 -0.322 . . . . 118.06 111.369 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -67.42 -34.54 77.44 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.312 -0.555 . . . . 136.28 111.296 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -65.1 -34.06 77.52 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.076 -0.649 . . . . 107.74 111.11 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LEU . . . . . 0.406 ' O ' HG13 ' A' ' 163' ' ' ILE . 48.9 tp -67.04 -43.71 82.05 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.299 -0.561 . . . . 109.74 110.94 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.09 -41.61 87.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-O 121.0 0.429 . . . . 106.33 110.137 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt85 -63.67 -35.18 79.71 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.334 -0.547 . . . . 113.82 111.121 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -66.14 -36.92 84.39 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.069 -0.653 . . . . 117.91 111.083 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ILE . . . . . 0.583 HD11 ' HA3' ' A' ' 77' ' ' GLY . 28.6 mt -68.68 -51.03 49.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 121.222 0.534 . . . . 117.28 110.217 173.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ARG . . . . . 0.559 ' NH2' ' OD2' ' A' ' 47' ' ' ASP . 7.9 tmm_? -63.08 -29.27 70.68 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.153 -0.342 . . . . 129.22 111.811 -175.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -90.88 8.91 32.58 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.057 0.762 . . . . 122.1 113.057 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 3.4 t60 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 118.376 0.535 . . . . 163.27 110.936 179.942 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 48.6 t30 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.508 0.194 . . . . 207.79 110.506 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . . . -156.46 148.04 22.64 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.454 -0.572 . . . . 188.12 109.454 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . . . -142.09 128.04 18.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 108.28 -1.007 . . . . 162.27 108.28 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . . . -99.18 144.57 28.15 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.902 0.481 . . . . 186.68 110.056 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . . . -139.59 149.38 22.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.061 -0.718 . . . . 162.43 109.061 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LEU . . . . . 0.464 ' HA ' ' HB3' ' B' ' 67' ' ' TRP . . . -95.7 157.11 16.04 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.696 0.76 . . . . 145.56 110.896 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . . . -131.55 168.72 16.19 Favored Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 124.213 1.005 . . . . 178.41 108.926 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -66.71 167.0 20.38 Favored 'Trans proline' 0 C--O 1.233 0.244 0 CA-C-O 122.322 0.884 . . . . 158.99 111.784 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 61.5 35.39 17.54 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.537 -1.211 . . . . 180.61 111.504 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . . . 57.21 42.0 26.06 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.48 0.657 . . . . 174.06 110.985 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HB3' ' CE1' ' B' ' 89' ' ' HIS . 86.2 mt-10 -116.73 166.12 12.5 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.899 0.88 . . . . 179.5 108.906 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' TRP . . . . . 0.464 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 12.5 p-90 -165.95 -179.01 4.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.771 -0.826 . . . . 163.55 108.771 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -173.38 144.02 1.13 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.793 1.237 . . . . 175.2 109.096 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 6.5 t -119.27 136.65 55.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.999 -0.741 . . . . 186.91 108.999 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.2 t -138.5 152.16 24.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 108.739 -0.837 . . . . 191.2 108.739 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . . . -94.99 164.85 12.72 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.621 0.724 . . . . 180.39 111.072 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' B' ' 119' ' ' ALA . 1.6 p . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 115.377 -0.829 . . . . 195.2 111.553 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' MET . . . . . 0.456 ' O ' ' N ' ' B' ' 118' ' ' ALA . . . . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.588 0.232 . . . . 234.63 111.111 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 40.8 t -64.02 126.27 27.15 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.319 -0.4 . . . . 282.81 110.546 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . . . -60.45 -31.7 70.68 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.957 -0.565 . . . . 206.4 111.386 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -70.55 -36.53 73.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.128 -0.629 . . . . 217.7 111.028 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . . . -76.22 -28.23 57.11 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.107 0.41 . . . . 243.75 112.107 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 40.7 t -76.34 -32.84 58.9 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.439 -0.504 . . . . 226.27 111.877 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 69.6 mt -104.96 16.85 25.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.533 0.568 . . . . 176.23 112.533 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . . . -70.63 -53.2 16.79 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.579 -0.448 . . . . 204.19 111.331 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -64.98 -40.99 95.79 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.446 -0.502 . . . . 179.65 111.471 -175.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.69 -35.68 77.5 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.327 -0.549 . . . . 186.8 111.426 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . . . -63.57 -44.16 94.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.477 -0.489 . . . . 148.58 110.927 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . . . -67.99 -36.6 80.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.281 -0.568 . . . . 174.94 111.036 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . 0.557 ' NH1' ' OD2' ' A' ' 38' ' ' ASP . 27.5 mtm105 -59.75 -50.85 72.24 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.626 -0.43 . . . . 194.93 110.863 174.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' B' ' 66' ' ' GLU . 1.3 t-160 -75.7 -9.79 58.89 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.629 0.603 . . . . 165.47 112.629 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.39 74.23 1.27 Allowed Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 118.272 0.487 . . . . 228.2 113.321 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . . . -161.66 134.22 5.97 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.963 -0.754 . . . . 208.59 108.963 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . . . -92.23 128.08 46.52 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 109.444 -0.576 . . . . 237.49 109.444 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -67.86 -11.12 31.04 Favored 'Trans proline' 0 C--O 1.237 0.467 0 N-CA-C 114.145 0.787 . . . . 260.01 114.145 -174.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . . . -80.84 -35.78 32.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.074 0.852 . . . . 260.36 111.338 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 26.8 t -78.13 -3.49 42.68 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.178 0.807 . . . . 231.69 113.178 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 20.1 m -143.88 166.87 23.71 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.585 0.707 . . . . 229.05 109.418 -176.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.49 161.09 42.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.901 -0.777 . . . . 236.25 108.901 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . 0.494 ' HA ' HG22 ' B' ' 128' ' ' VAL . . . -74.79 172.57 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 115.461 -0.79 . . . . 269.7 110.478 -173.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' PHE . . . . . 0.477 ' HA ' ' HA ' ' B' ' 111' ' ' ARG . 62.8 m-85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 267.05 110.091 175.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 213.5 111.116 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -138.66 119.96 14.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.879 -0.786 . . . . 257.98 108.879 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' B' ' 99' ' ' PHE . 64.7 ttp85 -76.57 142.55 40.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.161 0.505 . . . . 278.93 111.208 -175.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . . . -115.52 171.98 7.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.597 0.713 . . . . 258.97 109.492 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -76.15 153.64 36.05 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.491 -0.777 . . . . 292.6 110.927 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . . . -71.23 -31.17 67.23 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.49 -0.777 . . . . 218.23 111.799 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . . . -82.56 7.7 13.84 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.938 0.718 . . . . 208.97 112.938 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.0 m -67.37 145.75 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.499 0.666 . . . . 215.62 110.566 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -58.75 132.36 53.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.493 -0.776 . . . . 223.35 110.231 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' B' ' 76' ' ' MET . . . -70.97 -41.52 70.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.036 -0.529 . . . . 218.42 111.278 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' B' ' 72' ' ' VAL . . . -66.28 -0.99 2.91 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.561 0.948 . . . . 192.42 113.561 -179.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 22.5 m -75.52 -47.18 28.05 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.567 1.076 . . . . 227.87 111.199 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . . . -90.56 28.21 1.55 Allowed 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.74 0.645 . . . . 173.72 112.74 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.52 137.05 24.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.238 0.542 . . . . 204.68 109.736 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.28 -29.97 5.0 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-O 119.635 -0.536 . . . . 191.59 114.34 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . . . -92.3 136.41 33.22 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 117.773 0.786 . . . . 174.31 109.687 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . . . -99.8 137.26 38.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.936 -0.575 . . . . 193.43 110.101 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . . . -117.49 171.31 8.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.877 0.846 . . . . 182.34 110.21 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . . . -123.0 164.62 18.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.094 -0.957 . . . . 194.4 109.15 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' B' ' 98' ' ' VAL . 11.9 t -143.01 131.24 19.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.209 -0.663 . . . . 193.94 109.209 -175.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -137.97 169.55 17.59 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.534 -0.913 . . . . 229.87 108.534 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.765 -0.652 . . . . 200.95 111.347 -178.892 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' GNP . . . . . 0.509 ' N3B' ' O ' ' A' ' 12' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.304 0.853 . . . . 211.21 113.304 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -89.74 28.88 0.43 Allowed 'Trans proline' 0 C--N 1.356 0.942 0 CA-C-N 118.947 0.66 . . . . 208.98 112.427 176.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.4 ttm -120.13 132.41 55.4 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 109.41 -0.589 . . . . 190.66 109.41 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.0 m -107.64 142.34 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.074 0.55 . . . . 158.56 109.772 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -106.51 122.95 47.33 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 109.251 -0.648 . . . . 136.25 109.251 -177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -116.17 117.68 30.73 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.874 -0.787 . . . . 144.96 108.874 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -91.98 113.37 25.62 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 108.515 -0.92 . . . . 126.86 108.515 177.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.9 mt -112.09 144.21 41.84 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 122.658 0.383 . . . . 115.35 110.121 -174.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.78 137.36 58.09 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 108.46 -0.941 . . . . 124.69 108.46 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 85.7 t -114.33 120.05 63.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.041 -1.096 . . . . 117.4 108.041 177.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.58 156.09 37.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.795 0.807 . . . . 115.88 109.29 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 166.89 -164.92 38.17 Favored Glycine 0 N--CA 1.452 -0.291 0 N-CA-C 110.501 -1.039 . . . . 149.97 110.501 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.483 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . . . -73.07 -165.18 0.21 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.19 -0.505 . . . . 142.38 111.909 178.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.509 ' O ' ' N3B' ' A' ' 201' ' ' GNP . 2.7 t -85.47 -48.24 16.33 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.823 0.344 . . . . 188.09 111.348 -177.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -111.49 72.15 0.21 Allowed Glycine 0 N--CA 1.449 -0.46 0 O-C-N 121.553 -0.717 . . . . 162.27 113.497 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.9 m -121.72 -40.23 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 122.672 0.389 . . . . 124.96 111.881 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.03 29.29 0.95 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.195 -0.526 . . . . 102.66 113.664 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.483 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 36.1 mtmm -60.97 -34.81 75.34 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.09 -0.644 . . . . 120.9 110.861 176.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 m -84.95 -42.63 14.77 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.73 -0.388 . . . . 154.09 111.413 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.63 -39.72 92.3 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.184 -0.606 . . . . 126.69 111.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 25.7 mt -64.1 -45.95 86.36 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.409 -0.516 . . . . 106.91 110.969 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.5 m -68.54 -42.61 78.18 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.214 -0.594 . . . . 135.03 111.281 -179.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . . . -67.3 -38.16 80.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 C-N-CA 120.164 -0.614 . . . . 130.61 110.59 -178.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -63.41 -32.53 74.0 Favored 'General case' 0 C--O 1.236 0.347 0 O-C-N 121.898 -0.501 . . . . 163.86 111.478 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.9 tp -72.86 -36.24 67.38 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.459 -0.496 . . . . 132.79 111.535 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.691 HG22 ' HG3' ' A' ' 25' ' ' GLN . 1.7 mp -86.28 -48.45 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 O-C-N 122.129 -0.357 . . . . 126.9 111.647 -171.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.691 ' HG3' HG22 ' A' ' 24' ' ' ILE . 92.8 mt-30 -109.59 -0.45 18.7 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 113.721 1.008 . . . . 207.46 113.721 -174.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.8 m120 59.01 39.67 23.19 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.098 0.559 . . . . 164.62 111.874 175.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -148.99 137.01 20.74 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.73 -0.841 . . . . 169.51 108.73 173.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -89.25 131.0 35.56 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.803 -0.635 . . . . 160.95 110.127 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.63 107.64 16.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 107.888 -1.152 . . . . 165.79 107.888 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . . . -69.02 -36.73 78.1 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.112 -0.635 . . . . 165.98 111.231 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . . . -72.96 -179.6 3.28 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 122.037 0.923 . . . . 173.41 110.022 178.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.08 102.75 5.11 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.88 -0.785 . . . . 216.99 108.88 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -109.18 103.72 53.18 Favored Pre-proline 0 C--O 1.241 0.643 0 N-CA-C 107.696 -1.224 . . . . 185.81 107.696 169.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -59.99 127.93 24.94 Favored 'Trans proline' 0 C--N 1.332 -0.301 0 CA-C-N 119.073 0.705 . . . . 213.35 111.595 -176.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.1 p -81.61 135.12 35.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.699 -0.682 . . . . 178.99 110.935 -177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . . . -79.45 -71.62 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.193 -1.039 . . . . 165.8 108.193 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -151.47 128.5 11.08 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.284 -1.006 . . . . 177.28 108.284 172.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.557 ' OD2' ' NH1' ' B' ' 88' ' ' ARG . 77.5 m-20 -137.28 137.7 39.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.536 -0.542 . . . . 171.6 109.536 -177.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 t -126.0 125.74 43.17 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.055 -0.72 . . . . 151.3 109.055 177.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -123.3 165.65 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.625 0.726 . . . . 148.85 109.683 -179.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . . . -141.04 141.08 34.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.351 -0.84 . . . . 170.36 109.351 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . . . -151.75 132.65 14.19 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.249 -0.649 . . . . 150.49 109.249 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . . . -96.83 122.04 39.36 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.927 -0.768 . . . . 152.08 108.927 178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.2 m -132.26 170.43 19.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 CA-C-O 121.765 0.793 . . . . 138.08 109.007 -176.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 75.2 t -115.76 106.3 20.18 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 N-CA-C 107.098 -1.445 . . . . 138.83 107.098 175.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 59.1 mt -106.51 122.74 60.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 N-CA-C 107.602 -1.259 . . . . 125.21 107.602 177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.559 ' OD2' ' NH2' ' A' ' 164' ' ' ARG . 64.5 m-20 55.38 -102.08 0.14 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.102 -0.499 . . . . 152.44 110.42 -172.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -107.94 -33.75 2.95 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.607 -0.806 . . . . 127.9 114.959 -175.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -93.38 156.68 16.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.015 0.912 . . . . 196.9 111.829 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.2 m -88.95 131.76 35.01 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 114.899 -1.046 . . . . 158.25 108.49 172.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 35.5 m -128.32 134.19 48.85 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 110.107 -0.331 . . . . 131.39 110.107 -171.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . . . -100.58 121.73 42.09 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.069 -1.086 . . . . 143.39 108.069 172.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.1 mt -112.19 111.08 21.72 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 109.556 -0.535 . . . . 143.46 109.556 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . . . -88.15 122.34 31.59 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.243 -1.021 . . . . 143.66 108.243 169.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 72.0 mt -120.95 137.8 53.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.95 -0.759 . . . . 121.87 108.95 -173.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.11 120.98 39.4 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.392 -0.596 . . . . 139.41 109.392 -179.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -97.9 102.84 14.7 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 107.417 -1.327 . . . . 156.57 107.417 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.8 p -82.36 174.62 10.95 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.936 0.874 . . . . 142.87 110.236 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -101.94 131.25 48.44 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.209 -0.663 . . . . 180.17 109.209 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.12 -28.04 70.93 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.059 -1.067 . . . . 189.15 113.22 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . . . -63.47 131.22 47.47 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 117.334 0.567 . . . . 236.79 110.729 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . . . -70.76 -23.83 62.49 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.508 0.558 . . . . 254.07 112.508 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . . . -62.87 -32.83 74.16 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.301 -0.56 . . . . 266.59 111.384 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . . . -98.2 -12.42 21.69 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.774 0.657 . . . . 263.95 112.774 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . . . -88.03 17.28 5.1 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.486 0.55 . . . . 262.1 112.486 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -65.09 -42.75 93.75 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.262 -0.575 . . . . 251.86 110.729 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . . . -84.74 38.31 0.69 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 217.66 112.147 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . . . -70.34 -24.2 62.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.098 0.407 . . . . 207.28 112.098 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . . . -64.13 -32.5 74.09 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.328 -0.549 . . . . 195.26 111.578 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . . . -68.86 -47.81 65.01 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.723 -0.391 . . . . 183.78 111.26 -178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . . . -61.47 -38.22 86.46 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.739 -0.384 . . . . 178.68 111.248 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 42.9 mtt -75.07 -33.49 61.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.631 -0.428 . . . . 197.99 111.711 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . . . -66.86 -10.83 52.4 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 113.6 0.963 . . . . 195.57 113.6 -172.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 25.6 m -112.04 -37.01 5.2 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 113.449 0.907 . . . . 153.87 113.449 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.85 150.78 52.16 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.472 -0.87 . . . . 152.54 112.731 -175.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -107.53 -4.52 18.32 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.318 0.858 . . . . 140.17 113.318 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.583 ' HA3' HD11 ' A' ' 163' ' ' ILE . . . -152.28 151.67 23.5 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 109.877 -1.289 . . . . 120.29 109.877 176.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.605 ' HB2' ' HG2' ' A' ' 111' ' ' MET . 97.6 m-85 -135.45 129.1 32.68 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 120.805 -0.358 . . . . 124.85 111.014 -171.552 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.8 mt -100.15 112.57 24.88 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.731 -1.211 . . . . 110.35 107.731 169.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 61.9 m -96.83 112.2 24.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.874 -1.158 . . . . 125.33 107.874 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 50.4 t -110.41 133.18 56.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 109.136 -0.69 . . . . 130.84 109.136 -168.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -130.15 152.36 49.67 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.293 -1.002 . . . . 133.86 108.293 166.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.63 130.56 34.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.84 -0.618 . . . . 113.57 109.65 171.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 23.9 pt -69.44 -3.86 3.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 115.931 -0.577 . . . . 129.21 112.317 178.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -108.97 23.4 14.61 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 118.827 0.74 . . . . 141.74 111.822 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -137.84 96.74 3.28 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.723 -1.584 . . . . 136.94 106.723 -178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 34.3 m -62.6 -39.04 92.5 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.531 -0.468 . . . . 124.15 111.029 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -62.26 -43.84 97.9 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.689 -0.404 . . . . 161.19 111.282 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 60.5 p -60.05 -35.59 75.46 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.389 -0.524 . . . . 112.9 111.142 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -70.14 -40.4 74.83 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.402 -0.519 . . . . 123.29 111.147 177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -66.85 -25.95 66.67 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.529 -0.468 . . . . 138.46 111.647 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -80.71 -5.95 57.76 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.137 0.792 . . . . 195.89 113.137 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.3 mm -64.44 -35.49 74.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-N 118.607 0.64 . . . . 123.06 110.386 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 98' ' ' GLU . 6.4 t-80 -55.38 -43.33 75.07 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 122.033 -0.417 . . . . 171.16 111.182 177.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -60.7 -49.62 76.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.688 -0.405 . . . . 196.49 111.159 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' TYR . . . . . 0.458 ' O ' HG12 ' A' ' 100' ' ' ILE . 48.9 m-85 -60.13 -46.86 88.22 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.978 -0.289 . . . . 139.94 111.317 -176.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -59.86 -38.28 81.69 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.577 -0.449 . . . . 174.25 111.265 -178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 94' ' ' HIS . 74.0 mm-40 -63.38 -46.6 85.74 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.179 -0.609 . . . . 188.27 110.704 175.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . . . -61.68 -34.38 75.64 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.657 -0.417 . . . . 135.09 111.599 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 96' ' ' TYR . 51.8 mm -72.0 -50.66 35.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.353 -0.539 . . . . 142.34 110.225 176.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . . . -64.33 -18.63 64.81 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 112.262 0.467 . . . . 140.31 112.262 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -83.09 -54.76 4.8 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.105 0.411 . . . . 168.25 111.088 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 77.0 t -63.57 -32.67 57.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 120.913 -0.315 . . . . 189.25 111.056 -174.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -91.79 -12.62 33.28 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.028 0.751 . . . . 184.26 113.028 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.9 t0 49.27 70.66 0.45 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 122.37 1.081 . . . . 203.96 110.772 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.8 t -165.66 141.65 5.19 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.013 -1.449 . . . . 189.39 108.85 -179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . . . -83.23 -12.37 56.87 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-N 115.594 -0.73 . . . . 186.18 112.513 169.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -124.57 107.36 10.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.195 -1.039 . . . . 189.36 108.195 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.7 136.06 28.49 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 107.98 -1.118 . . . . 148.97 107.98 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -58.05 104.88 0.18 Allowed 'Trans proline' 0 C--O 1.235 0.345 0 CA-C-N 119.097 0.713 . . . . 129.38 112.781 176.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.605 ' HG2' ' HB2' ' A' ' 78' ' ' PHE . 59.6 mtm -140.07 158.71 43.62 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.527 0.679 . . . . 127.39 109.415 179.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 32.9 t -140.1 127.64 24.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 108.124 -1.065 . . . . 106.88 108.124 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 34.4 tp -83.66 126.75 33.18 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 109.17 -0.678 . . . . 104.62 109.17 175.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 14.4 t -123.63 121.06 61.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 108.972 -0.751 . . . . 101.03 108.972 -175.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -92.43 106.41 3.4 Favored Glycine 0 N--CA 1.449 -0.459 0 N-CA-C 111.034 -0.826 . . . . 102.51 111.034 171.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -90.16 171.27 9.64 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.821 0.82 . . . . 107.92 111.014 -172.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 98.3 mttt 61.26 42.71 11.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.17 -0.923 . . . . 145.26 111.527 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 5.3 p -82.8 8.31 12.66 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.74 0.645 . . . . 135.55 112.74 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -84.68 -8.24 58.93 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.84 0.681 . . . . 158.99 112.84 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 24.8 mt -94.93 169.95 9.77 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.954 0.883 . . . . 154.74 110.657 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -107.87 172.0 7.08 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.349 -0.841 . . . . 151.37 109.604 174.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 60.14 49.39 7.41 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.208 -0.906 . . . . 191.62 111.263 177.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -66.31 130.8 44.44 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.898 -0.592 . . . . 152.82 110.333 -179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 71.9 p -76.87 -22.9 52.78 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.904 -0.589 . . . . 148.63 112.501 176.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 59.9 t -111.76 118.67 58.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 107.995 -1.113 . . . . 138.55 107.995 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -76.43 160.06 29.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.702 0.763 . . . . 180.35 110.087 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 47.5 t -63.91 -42.37 97.43 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.443 -0.799 . . . . 122.72 111.056 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . . . -57.09 -33.83 67.69 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.869 0.322 . . . . 130.89 111.869 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -64.7 -54.92 23.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.485 -0.486 . . . . 156.15 110.647 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.02 -26.63 68.94 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.665 -0.414 . . . . 117.68 111.747 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -63.18 -49.68 73.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.738 -0.385 . . . . 133.82 111.004 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -64.46 -36.66 84.89 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.745 -0.382 . . . . 155.48 111.452 -175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 34.1 tp -63.63 -47.83 79.78 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.316 -0.553 . . . . 114.93 110.937 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.06 79.54 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.369 -0.532 . . . . 131.47 110.99 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 16.9 ttm-85 -63.62 -33.7 76.2 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.564 -0.454 . . . . 170.1 111.343 176.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 95.2 p -70.16 -38.97 75.59 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.443 -0.503 . . . . 130.73 111.139 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -78.28 -16.99 57.22 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 112.784 0.661 . . . . 141.99 112.784 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 78.34 26.56 59.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.565 -0.826 . . . . 120.1 113.953 -175.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 25.7 pt -122.55 160.88 46.54 Favored Pre-proline 0 C--O 1.245 0.816 0 N-CA-C 107.651 -1.24 . . . . 114.44 107.651 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.01 160.63 13.71 Favored 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 120.648 0.899 . . . . 99.97 112.48 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -120.54 131.7 54.81 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 114.513 -1.221 . . . . 111.66 109.201 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.4 133.81 49.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.512 -0.921 . . . . 110.5 108.512 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -95.07 132.35 40.05 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.836 -0.431 . . . . 112.74 109.836 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 37.4 p -128.83 165.37 21.12 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.928 0.87 . . . . 110.09 110.451 -174.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 23.2 t -147.35 111.97 5.31 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.255 -1.387 . . . . 114.93 107.255 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -63.53 -32.72 74.26 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.078 -0.649 . . . . 129.49 111.579 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . . . -71.47 -47.19 57.2 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.52 -0.472 . . . . 126.67 111.031 177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 1.6 m -77.65 -15.64 59.06 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.753 0.649 . . . . 163.94 112.753 -177.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 40.8 ttt85 59.44 23.39 11.96 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.817 0.847 . . . . 140.11 111.638 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -77.84 123.46 26.76 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.519 -0.549 . . . . 182.41 109.519 179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 61.99 11.03 29.53 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 115.007 0.763 . . . . 117.36 115.007 175.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 48.9 t -66.89 -46.92 84.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-N 117.287 0.544 . . . . 124.37 110.441 -179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -63.96 -44.89 91.41 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.854 -0.528 . . . . 187.49 110.937 174.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -57.04 -39.08 74.15 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.958 -0.297 . . . . 151.96 111.215 -177.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ALA . . . . . . . . . . . . . . . -65.32 -54.57 27.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.876 0.37 . . . . 120.33 111.358 -177.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -62.9 -44.9 94.85 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.184 -0.322 . . . . 118.06 111.369 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -67.42 -34.54 77.44 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.312 -0.555 . . . . 136.28 111.296 -176.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' THR . . . . . . . . . . . . . 60.1 m -65.1 -34.06 77.52 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.076 -0.649 . . . . 107.74 111.11 175.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.406 ' O ' HG13 ' A' ' 163' ' ' ILE . 48.9 tp -67.04 -43.71 82.05 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.299 -0.561 . . . . 109.74 110.94 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 93.1 t -60.09 -41.61 87.05 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-O 121.0 0.429 . . . . 106.33 110.137 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 76.6 mtt85 -63.67 -35.18 79.71 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 120.334 -0.547 . . . . 113.82 111.121 175.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -66.14 -36.92 84.39 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.069 -0.653 . . . . 117.91 111.083 176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.583 HD11 ' HA3' ' A' ' 77' ' ' GLY . 28.6 mt -68.68 -51.03 49.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-O 121.222 0.534 . . . . 117.28 110.217 173.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.559 ' NH2' ' OD2' ' A' ' 47' ' ' ASP . 7.9 tmm_? -63.08 -29.27 70.68 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 122.153 -0.342 . . . . 129.22 111.811 -175.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -90.88 8.91 32.58 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 113.057 0.762 . . . . 122.1 113.057 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 3.4 t60 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 118.376 0.535 . . . . 163.27 110.936 179.942 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 48.6 t30 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.508 0.194 . . . . 207.79 110.506 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . . . -156.46 148.04 22.64 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 109.454 -0.572 . . . . 188.12 109.454 -177.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . . . -142.09 128.04 18.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 108.28 -1.007 . . . . 162.27 108.28 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . . . -99.18 144.57 28.15 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.902 0.481 . . . . 186.68 110.056 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . . . -139.59 149.38 22.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 N-CA-C 109.061 -0.718 . . . . 162.43 109.061 -177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LEU . . . . . 0.464 ' HA ' ' HB3' ' B' ' 67' ' ' TRP . . . -95.7 157.11 16.04 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.696 0.76 . . . . 145.56 110.896 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . . . -131.55 168.72 16.19 Favored Pre-proline 0 C--N 1.324 -0.526 0 C-N-CA 124.213 1.005 . . . . 178.41 108.926 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -66.71 167.0 20.38 Favored 'Trans proline' 0 C--O 1.233 0.244 0 CA-C-O 122.322 0.884 . . . . 158.99 111.784 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 35.3 m-20 61.5 35.39 17.54 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 114.537 -1.211 . . . . 180.61 111.504 176.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . . . 57.21 42.0 26.06 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.48 0.657 . . . . 174.06 110.985 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' GLU . . . . . 0.463 ' HB3' ' CE1' ' B' ' 89' ' ' HIS . 86.2 mt-10 -116.73 166.12 12.5 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.899 0.88 . . . . 179.5 108.906 178.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.464 ' HB3' ' HA ' ' B' ' 61' ' ' LEU . 12.5 p-90 -165.95 -179.01 4.98 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.771 -0.826 . . . . 163.55 108.771 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -173.38 144.02 1.13 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.793 1.237 . . . . 175.2 109.096 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 6.5 t -119.27 136.65 55.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 108.999 -0.741 . . . . 186.91 108.999 178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.2 t -138.5 152.16 24.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 108.739 -0.837 . . . . 191.2 108.739 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . . . -94.99 164.85 12.72 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.621 0.724 . . . . 180.39 111.072 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' B' ' 119' ' ' ALA . 1.6 p . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 115.377 -0.829 . . . . 195.2 111.553 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' MET . . . . . 0.456 ' O ' ' N ' ' B' ' 118' ' ' ALA . . . . . . . . 0 N--CA 1.458 -0.072 0 CA-C-O 120.588 0.232 . . . . 234.63 111.111 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 40.8 t -64.02 126.27 27.15 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.319 -0.4 . . . . 282.81 110.546 -179.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . . . -60.45 -31.7 70.68 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.957 -0.565 . . . . 206.4 111.386 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . . . -70.55 -36.53 73.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.128 -0.629 . . . . 217.7 111.028 174.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . . . -76.22 -28.23 57.11 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 112.107 0.41 . . . . 243.75 112.107 178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 40.7 t -76.34 -32.84 58.9 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.439 -0.504 . . . . 226.27 111.877 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 69.6 mt -104.96 16.85 25.18 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.533 0.568 . . . . 176.23 112.533 -179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' MET . . . . . . . . . . . . . . . -70.63 -53.2 16.79 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.579 -0.448 . . . . 204.19 111.331 -176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -64.98 -40.99 95.79 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.446 -0.502 . . . . 179.65 111.471 -175.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.69 -35.68 77.5 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.327 -0.549 . . . . 186.8 111.426 -177.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . . . -63.57 -44.16 94.9 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.477 -0.489 . . . . 148.58 110.927 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . . . -67.99 -36.6 80.3 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.281 -0.568 . . . . 174.94 111.036 175.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . 0.557 ' NH1' ' OD2' ' A' ' 38' ' ' ASP . 27.5 mtm105 -59.75 -50.85 72.24 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.626 -0.43 . . . . 194.93 110.863 174.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' B' ' 66' ' ' GLU . 1.3 t-160 -75.7 -9.79 58.89 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.629 0.603 . . . . 165.47 112.629 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 86.39 74.23 1.27 Allowed Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 118.272 0.487 . . . . 228.2 113.321 179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . . . -161.66 134.22 5.97 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.963 -0.754 . . . . 208.59 108.963 -179.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . . . -92.23 128.08 46.52 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 109.444 -0.576 . . . . 237.49 109.444 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -67.86 -11.12 31.04 Favored 'Trans proline' 0 C--O 1.237 0.467 0 N-CA-C 114.145 0.787 . . . . 260.01 114.145 -174.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . . . -80.84 -35.78 32.38 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.074 0.852 . . . . 260.36 111.338 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 26.8 t -78.13 -3.49 42.68 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.178 0.807 . . . . 231.69 113.178 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 20.1 m -143.88 166.87 23.71 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.585 0.707 . . . . 229.05 109.418 -176.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -153.49 161.09 42.59 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.901 -0.777 . . . . 236.25 108.901 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.494 ' HA ' HG22 ' B' ' 128' ' ' VAL . . . -74.79 172.57 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 115.461 -0.79 . . . . 269.7 110.478 -173.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.477 ' HA ' ' HA ' ' B' ' 111' ' ' ARG . 62.8 m-85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 267.05 110.091 175.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.606 0.241 . . . . 213.5 111.116 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -138.66 119.96 14.77 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.879 -0.786 . . . . 257.98 108.879 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' B' ' 99' ' ' PHE . 64.7 ttp85 -76.57 142.55 40.74 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.161 0.505 . . . . 278.93 111.208 -175.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . . . -115.52 171.98 7.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.597 0.713 . . . . 258.97 109.492 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . -76.15 153.64 36.05 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.491 -0.777 . . . . 292.6 110.927 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . . . -71.23 -31.17 67.23 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.49 -0.777 . . . . 218.23 111.799 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ASN . . . . . . . . . . . . . . . -82.56 7.7 13.84 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.938 0.718 . . . . 208.97 112.938 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 14.0 m -67.37 145.75 54.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.499 0.666 . . . . 215.62 110.566 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -58.75 132.36 53.65 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.493 -0.776 . . . . 223.35 110.231 176.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' B' ' 76' ' ' MET . . . -70.97 -41.52 70.92 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.036 -0.529 . . . . 218.42 111.278 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' B' ' 72' ' ' VAL . . . -66.28 -0.99 2.91 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 113.561 0.948 . . . . 192.42 113.561 -179.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' SER . . . . . . . . . . . . . 22.5 m -75.52 -47.18 28.05 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.567 1.076 . . . . 227.87 111.199 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . . . -90.56 28.21 1.55 Allowed 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.74 0.645 . . . . 173.72 112.74 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.52 137.05 24.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-O 121.238 0.542 . . . . 204.68 109.736 178.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' GLY . . . . . . . . . . . . . . . 87.28 -29.97 5.0 Favored Glycine 0 N--CA 1.444 -0.799 0 CA-C-O 119.635 -0.536 . . . . 191.59 114.34 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . . . -92.3 136.41 33.22 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 117.773 0.786 . . . . 174.31 109.687 176.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLU . . . . . . . . . . . . . . . -99.8 137.26 38.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.936 -0.575 . . . . 193.43 110.101 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' LEU . . . . . . . . . . . . . . . -117.49 171.31 8.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.877 0.846 . . . . 182.34 110.21 -178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . . . -123.0 164.62 18.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.094 -0.957 . . . . 194.4 109.15 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' VAL . . . . . 0.494 HG22 ' HA ' ' B' ' 98' ' ' VAL . 11.9 t -143.01 131.24 19.63 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 109.209 -0.663 . . . . 193.94 109.209 -175.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -137.97 169.55 17.59 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 108.534 -0.913 . . . . 229.87 108.534 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 115.765 -0.652 . . . . 200.95 111.347 -178.892 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' GNP . . . . . 0.509 ' N3B' ' O ' ' A' ' 12' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_