data_1gnn_residue 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 1gnn _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo . . . . . 0 N--CA 1.435 -1.964 0 CA-C-O 121.855 0.69 . . . . 29.1 111.275 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -98.19 120.97 39.53 Favored 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 104.972 -2.233 . . . . 39.87 104.972 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 58.4 mt -112.3 127.85 69.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 125.997 2.808 . . . . 22.66 104.946 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.259 28.4 p -97.24 159.43 14.92 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 103.512 -2.773 . . . . 19.31 103.512 179.359 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -107.17 15.57 25.01 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 112.183 -2.281 . . . . 16.46 115.299 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -69.22 -21.81 63.91 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 117.899 -1.52 . . . . 15.69 109.383 173.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.35 156.93 34.4 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 112.267 -3.73 . . . . 33.38 107.527 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -55.67 141.2 65.55 Favored Pre-proline 0 N--CA 1.488 1.431 1 CA-C-N 127.188 4.54 . . . . 35.02 110.0 174.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -87.62 89.99 0.54 Allowed 'Trans proline' 0 C--O 1.226 -0.087 0 N-CA-C 108.435 -1.409 . . . . 15.7 108.435 -177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.4 mt -105.35 145.13 31.17 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 124.074 0.95 . . . . 19.22 110.22 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.359 0.4 OUTLIER -144.43 153.91 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.297 0 C-N-CA 113.109 -3.436 . . . . 14.89 107.844 -171.425 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 88.4 m -85.13 130.06 34.68 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 126.205 2.907 . . . . 20.06 108.832 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.3 pt -116.12 146.17 20.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 O-C-N 119.236 -2.165 . . . . 14.36 111.93 168.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -105.88 117.03 32.97 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.35 -2.833 . . . . 25.15 103.35 167.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 tt -135.46 121.69 32.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.163 -1.421 . . . . 16.09 107.163 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.8 41.36 93.96 Favored Glycine 0 N--CA 1.434 -1.466 0 O-C-N 121.189 -0.944 . . . . 15.54 115.098 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.46 81.18 Favored Glycine 0 C--O 1.217 -0.911 0 C-N-CA 124.23 0.919 . . . . 17.2 114.28 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -135.69 137.94 42.28 Favored 'General case' 0 C--N 1.304 -1.402 1 O-C-N 114.672 -5.017 . . . . 17.26 108.037 -168.639 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.5 mt -95.77 133.04 40.36 Favored 'General case' 0 C--O 1.216 -0.679 0 O-C-N 125.561 1.788 . . . . 11.85 107.746 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -141.04 162.38 35.61 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.13 0.972 . . . . 19.02 111.265 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -107.66 145.44 33.35 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.621 -1.992 . . . . 24.99 105.621 171.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -147.45 153.67 39.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.818 -1.179 . . . . 10.09 107.818 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . 0.296 0.4 OUTLIER -94.33 135.5 35.67 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 113.224 -1.807 . . . . 16.26 109.94 -179.837 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.2 110.68 18.72 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 104.839 -2.282 . . . . 14.15 104.839 -179.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -122.0 99.55 6.5 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 124.245 1.974 . . . . 9.72 116.263 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.8 p -70.18 -8.93 53.82 Favored 'General case' 0 CA--C 1.511 -0.537 1 O-C-N 113.39 -5.819 . . . . 13.48 112.695 177.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -95.24 -0.86 63.0 Favored Glycine 0 C--N 1.317 -0.526 0 O-C-N 120.205 -1.559 . . . . 11.99 112.61 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.1 126.93 53.0 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 120.46 -1.611 . . . . 9.6 107.254 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -79.54 -24.4 42.2 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 113.183 -3.294 . . . . 18.44 108.768 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.4 173.65 7.52 Favored 'General case' 0 N--CA 1.433 -1.292 1 O-C-N 130.252 4.72 . . . . 18.9 112.798 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.0 m -108.84 121.84 45.93 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 128.7 2.8 . . . . 11.14 105.636 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . 0.327 0.2 OUTLIER -133.57 130.07 56.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 105.594 -2.002 . . . . 13.81 105.594 -175.709 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.8 mt -116.09 150.86 36.66 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-O 114.723 -2.56 . . . . 19.42 107.19 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.66 160.75 16.25 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.033 1.873 . . . . 36.94 106.07 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' A' ' 130' ' ' HOH . 14.9 tp10 -43.06 127.85 4.31 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 127.486 3.517 . . . . 37.13 114.935 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.0 ptm -150.84 172.31 15.83 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.88 -1.963 . . . . 28.47 111.519 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 p -100.41 114.17 27.51 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 128.832 3.833 . . . . 30.63 107.441 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -120.78 136.54 25.54 Favored Pre-proline 0 N--CA 1.472 0.626 0 CA-C-N 111.029 -2.805 . . . . 30.96 104.647 178.722 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -70.46 145.89 54.35 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 N-CA-C 107.838 -1.639 . . . . 31.97 107.838 172.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.06 -169.71 13.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 121.368 3.307 . . . . 38.17 121.368 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER -97.37 155.92 16.68 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 112.057 -2.071 . . . . 49.04 107.58 179.378 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 59.2 p-90 -152.08 141.9 21.98 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 125.432 1.708 . . . . 40.02 114.974 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' O ' ' N ' ' A' ' 58' ' ' GLN . 8.7 mmmt -97.58 140.69 22.14 Favored Pre-proline 0 N--CA 1.471 0.607 0 O-C-N 119.334 -2.104 . . . . 46.48 105.509 179.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -67.5 147.52 77.16 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 124.446 3.431 . . . . 34.1 111.02 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.525 ' O ' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -163.04 164.54 25.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 124.937 2.303 . . . . 36.16 109.601 175.388 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MET . . . . . 0.49 ' CE ' ' O ' ' A' ' 143' ' ' HOH . 20.7 mtm -129.27 128.44 43.23 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 131.04 3.736 . . . . 48.26 107.813 -175.159 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . 0.544 ' CG2' ' N3 ' ' A' ' 101' ' ' U0E . 0.3 OUTLIER -117.96 162.22 16.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 N-CA-C 106.558 -1.645 . . . . 26.64 106.558 -178.373 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . 0.511 ' O ' ' N4 ' ' A' ' 101' ' ' U0E . . . -120.42 147.66 17.78 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 117.521 -2.276 . . . . 23.81 109.413 179.042 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . 0.443 ' CA ' ' CG2' ' B' ' 50' ' ' ILE . . . -148.13 -149.46 4.97 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 104.76 -3.336 . . . . 21.12 104.76 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 1.2 tp -75.58 -45.45 39.18 Favored 'Isoleucine or valine' 0 C--O 1.249 1.071 1 CA-C-O 111.195 -4.241 . . . . 23.34 112.7 -171.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -105.35 20.17 38.16 Favored Glycine 0 N--CA 1.477 1.433 1 CA-C-N 131.355 6.434 . . . . 21.39 112.285 -172.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.44 -145.86 17.63 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 124.533 2.185 . . . . 21.23 118.329 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.72 136.61 51.78 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 126.982 3.277 . . . . 26.92 106.154 -167.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.5 pt -112.9 155.71 14.06 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.115 -1.857 . . . . 21.91 108.091 171.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.29 123.59 39.98 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 127.794 2.438 . . . . 34.78 105.209 171.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . 0.525 ' N ' ' O ' ' A' ' 45' ' ' LYS . 18.6 m -126.28 174.3 10.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 O-C-N 124.067 0.854 . . . . 20.04 109.949 -179.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.347 5.9 mtt180 -112.5 130.72 55.9 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 114.125 -2.845 . . . . 38.22 106.9 173.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' A' ' 43' ' ' LYS . 1.1 pt20 -98.55 155.49 17.26 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 113.305 -3.358 . . . . 24.79 110.681 174.121 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -133.72 133.07 41.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 129.124 2.97 . . . . 23.0 104.235 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -110.43 148.86 31.19 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 126.026 2.079 . . . . 34.18 107.645 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.69 40.77 9.85 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 124.71 2.195 . . . . 35.76 113.317 174.594 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 18.2 mm -93.37 128.81 44.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 O-C-N 119.527 -1.983 . . . . 17.41 107.583 173.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -78.9 129.65 34.77 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 127.215 3.388 . . . . 13.06 111.118 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 4.9 tt -136.53 129.84 46.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 126.316 2.96 . . . . 15.73 104.126 -178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -105.91 121.79 44.8 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 127.345 3.45 . . . . 26.79 106.344 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . 0.43 ' N ' ' O ' ' A' ' 69' ' ' HIS . 15.8 mt -118.47 113.33 41.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 O-C-N 118.098 -2.876 . . . . 21.59 109.972 -173.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' CYS . . . . . 0.763 ' SG ' ' O ' ' A' ' 122' ' ' HOH . 0.1 OUTLIER 48.26 59.71 4.1 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 127.387 2.929 . . . . 40.93 109.377 -174.108 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.85 -24.08 0.67 Allowed Glycine 0 C--O 1.253 1.33 1 O-C-N 115.643 -4.411 . . . . 30.53 115.502 -178.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HIS . . . . . 0.43 ' O ' ' N ' ' A' ' 66' ' ' ILE . 11.5 m80 -85.88 136.13 33.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 120.09 1.945 . . . . 33.55 107.723 -174.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.62 137.34 32.42 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 126.087 1.755 . . . . 29.57 114.292 176.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -144.95 158.98 43.63 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 119.053 -2.28 . . . . 16.66 105.53 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . 0.284 1.9 tt -135.01 131.69 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 103.785 -2.672 . . . . 20.85 103.785 179.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.84 -166.7 32.44 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-O 127.101 3.612 . . . . 15.41 112.147 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . 0.307 61.0 m -86.55 133.14 33.75 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 118.666 -2.667 . . . . 21.5 111.783 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.9 t -122.92 128.1 75.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 104.387 -2.449 . . . . 18.09 104.387 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.3 mt -93.73 127.56 39.51 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 121.3 1.864 . . . . 16.83 106.376 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 65.8 t -110.86 130.1 64.87 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-O 115.21 -2.329 . . . . 18.74 105.674 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 176.87 -163.37 32.24 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 121.598 1.999 . . . . 16.85 109.253 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -85.92 52.49 3.02 Favored 'Trans proline' 0 C--O 1.261 1.665 0 N-CA-C 120.869 3.373 . . . . 18.47 120.869 -175.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 t -73.56 151.64 89.42 Favored Pre-proline 0 C--N 1.324 -0.529 0 O-C-N 118.772 -2.455 . . . . 17.51 105.214 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . 0.664 ' CG ' ' C9 ' ' A' ' 101' ' ' U0E . 98.1 Cg_endo -72.58 -23.54 19.74 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.723 1.615 . . . . 20.81 111.737 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . 0.306 1.9 m120 -141.05 154.07 45.8 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 118.075 -2.891 . . . . 29.44 113.417 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -67.58 126.5 29.54 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.058 -1.83 . . . . 12.81 106.058 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . 0.468 ' CD1' ' CD1' ' B' ' 50' ' ' ILE . 3.6 mt -119.54 119.83 61.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 C-N-CA 129.47 3.108 . . . . 16.86 111.355 -174.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.25 109.35 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 101.681 -3.451 . . . . 9.35 101.681 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.96 -173.19 34.5 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 107.411 -2.276 . . . . 8.85 107.411 -177.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . 0.541 ' NE ' ' O ' ' A' ' 102' ' ' HOH . 29.3 mtm105 -65.13 -22.05 66.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 112.648 -3.549 . . . . 12.84 112.588 -177.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -63.22 -25.12 68.18 Favored 'General case' 0 C--N 1.309 -1.163 1 CA-C-N 126.76 4.346 . . . . 13.18 111.784 171.988 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.6 mt -106.02 -31.94 8.52 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 121.572 1.987 . . . . 13.19 110.228 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 67.0 mt -56.96 -36.99 70.93 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 118.627 0.649 . . . . 10.59 111.318 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 25.5 p -72.43 -20.1 61.47 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 116.44 -3.913 . . . . 15.55 110.687 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -76.41 -34.84 58.82 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 122.543 2.429 . . . . 24.2 116.53 177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.25 6.84 3.89 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 CA-C-O 125.215 2.436 . . . . 18.17 111.724 174.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.62 48.45 10.44 Favored Glycine 0 N--CA 1.43 -1.756 2 C-N-CA 132.908 5.051 . . . . 17.83 110.736 171.437 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . 0.355 0.0 OUTLIER -101.2 144.09 30.49 Favored 'General case' 0 N--CA 1.498 1.951 1 C-N-CA 110.776 -4.37 . . . . 22.93 108.915 -166.663 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.7 p -128.03 178.96 5.84 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 123.534 1.635 . . . . 17.07 110.864 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . 0.411 ' O ' ' N ' ' B' ' 3' ' ' ILE 0.308 14.7 tp -129.74 131.83 46.4 Favored 'General case' 0 C--N 1.295 -1.79 1 N-CA-C 100.144 -4.021 . . . . 20.82 100.144 -177.549 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . 0.479 ' OD1' ' ND2' ' B' ' 98' ' ' ASN . 0.1 OUTLIER -139.85 141.46 36.65 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 126.295 2.95 . . . . 32.26 108.983 -174.91 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 32.2 p90 . . . . . 0 C--N 1.315 -0.896 0 N-CA-C 103.924 -2.621 . . . . 28.32 103.924 179.598 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo . . . . . 0 N--CA 1.425 -2.515 0 CA-C-O 128.514 3.464 . . . . 31.09 114.248 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -117.75 121.93 42.13 Favored 'General case' 0 C--O 1.243 0.721 1 CA-C-N 107.303 -4.499 . . . . 35.37 104.698 170.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . 0.411 ' N ' ' O ' ' A' ' 97' ' ' LEU . 1.3 mt -110.04 121.92 63.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.724 -1.584 . . . . 22.39 106.724 -177.392 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 73.9 p -93.87 157.94 15.89 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.692 -1.225 . . . . 23.9 107.692 172.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.77 15.73 28.07 Favored 'General case' 0 CA--C 1.493 -1.239 0 N-CA-C 119.46 3.133 . . . . 15.38 119.46 -167.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -61.01 -29.96 70.02 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 126.408 3.004 . . . . 17.66 114.536 166.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -122.73 156.74 33.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 117.382 -3.324 . . . . 29.84 104.636 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -49.21 128.99 16.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 120.15 -1.594 . . . . 45.3 109.964 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -71.94 86.85 0.89 Allowed 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 123.067 2.511 . . . . 12.67 111.519 173.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . 0.26 12.1 mt -107.75 141.53 39.14 Favored 'General case' 0 N--CA 1.44 -0.956 1 O-C-N 115.904 -4.247 . . . . 17.9 108.911 -169.868 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . 0.398 0.4 OUTLIER -145.88 154.37 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 1 C-N-CA 110.469 -4.493 . . . . 12.45 105.93 -169.614 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -82.15 130.45 35.09 Favored 'General case' 0 C--N 1.304 -1.393 1 CA-C-O 129.411 4.434 . . . . 20.79 112.357 170.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.1 pt -123.24 153.79 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-O 127.204 3.383 . . . . 14.13 107.661 172.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -123.42 122.57 38.6 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 101.717 -3.438 . . . . 28.79 101.717 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.0 tt -151.4 124.57 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 O-C-N 128.373 3.546 . . . . 16.55 108.185 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.05 38.25 95.74 Favored Glycine 0 C--O 1.22 -0.724 0 CA-C-O 123.341 1.523 . . . . 16.67 115.46 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.26 -5.12 81.72 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.013 -1.093 . . . . 20.42 110.958 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -110.65 140.87 44.6 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 119.494 3.146 . . . . 17.81 119.494 -172.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.92 131.52 37.18 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 126.865 2.603 . . . . 12.58 109.204 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -144.59 168.4 20.24 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.833 -0.603 . . . . 19.85 111.375 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -114.29 134.39 54.98 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 116.074 -1.917 . . . . 24.91 106.198 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -134.92 149.77 50.32 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 119.918 1.235 . . . . 8.38 110.244 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . 0.272 0.3 OUTLIER -85.89 136.6 33.22 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.553 -0.748 . . . . 17.26 112.077 175.865 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.68 116.09 23.02 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 119.076 -2.265 . . . . 11.9 106.433 177.025 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -127.36 101.3 6.4 Favored 'General case' 0 CA--C 1.51 -0.595 0 C-N-CA 118.634 -1.227 . . . . 13.09 111.31 -167.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.8 p -70.55 -16.78 62.91 Favored 'General case' 0 CA--C 1.49 -1.362 0 C-N-CA 116.171 -2.212 . . . . 10.75 110.215 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.24 8.91 62.44 Favored Glycine 0 C--O 1.227 -0.316 2 CA-C-N 127.199 4.545 . . . . 12.23 111.785 178.26 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -116.84 119.03 34.12 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 116.955 -3.674 . . . . 10.37 107.429 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -60.26 -41.09 92.53 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 116.783 -3.698 . . . . 15.2 112.354 171.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . 0.466 ' OD2' ' N3 ' ' A' ' 100' ' ' U0E 0.427 65.9 m-20 -112.51 164.61 13.09 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 134.057 4.943 . . . . 17.62 119.099 -176.748 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 26.3 m -104.57 120.2 40.74 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.786 -1.19 . . . . 12.47 107.786 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . . . . . . . . . 1.9 p -123.36 121.05 61.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 114.688 -1.142 . . . . 14.44 109.543 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.54 144.45 48.06 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 127.714 3.626 . . . . 20.16 105.3 -175.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -44.09 149.81 0.32 Allowed 'General case' 0 C--N 1.304 -1.378 0 O-C-N 118.918 -2.364 . . . . 39.85 106.185 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . 0.467 ' OE2' ' NH1' ' B' ' 57' ' ' ARG . 0.4 OUTLIER -52.96 116.26 2.27 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 126.702 3.144 . . . . 40.98 113.197 177.704 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 5.4 ptt? -147.47 172.74 13.48 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 118.921 -2.362 . . . . 31.8 111.161 -175.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 71.9 m -81.69 109.72 16.37 Favored 'General case' 0 C--O 1.252 1.231 1 O-C-N 130.226 4.704 . . . . 39.75 113.902 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -134.4 125.52 17.78 Favored Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 115.912 -2.315 . . . . 35.78 106.59 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.23 149.63 81.54 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 125.895 2.524 . . . . 36.9 111.699 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 116.84 -171.59 13.86 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 124.65 2.25 . . . . 38.86 113.675 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -106.93 156.0 19.18 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.348 -1.723 . . . . 55.9 106.348 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . 0.306 32.7 p-90 -147.8 169.04 20.63 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 124.769 1.228 . . . . 37.35 110.264 174.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -119.36 138.23 26.21 Favored Pre-proline 0 C--O 1.215 -0.722 0 O-C-N 126.41 2.319 . . . . 40.54 110.832 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -59.42 140.34 93.77 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.131 -2.68 . . . . 31.13 105.131 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -150.13 169.06 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 101.569 -3.493 . . . . 31.04 101.569 177.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' MET . . . . . . . . . . . . 0.263 30.0 mtt -143.31 136.32 27.83 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 120.936 1.698 . . . . 37.24 109.835 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 17.4 pt -124.81 160.01 30.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.305 0 CA-C-O 126.582 3.087 . . . . 23.2 112.405 173.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLY . . . . . 0.41 ' O ' ' N4 ' ' A' ' 100' ' ' U0E . . . -114.65 158.61 14.21 Favored Glycine 0 C--O 1.217 -0.948 1 CA-C-O 128.025 4.125 . . . . 18.85 116.3 174.812 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -154.89 -151.12 5.74 Favored Glycine 0 C--O 1.214 -1.131 0 N-CA-C 103.896 -3.682 . . . . 16.34 103.896 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . 0.468 ' CD1' ' CD1' ' A' ' 84' ' ' ILE 0.492 0.0 OUTLIER -76.06 138.01 21.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 120.516 -1.579 . . . . 23.65 106.966 179.993 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.32 -26.07 19.35 Favored Glycine 0 C--O 1.246 0.875 2 O-C-N 114.804 -4.935 . . . . 25.69 109.742 -176.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.84 -152.0 21.54 Favored Glycine 0 C--N 1.337 0.596 1 CA-C-N 125.181 4.49 . . . . 23.32 118.577 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . 0.28 0.0 OUTLIER -110.99 140.61 45.37 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 112.706 -3.521 . . . . 32.55 114.635 -173.582 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 29.2 pt -123.5 158.61 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 114.253 -2.979 . . . . 21.95 108.007 169.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -96.12 126.96 41.71 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 104.993 -2.225 . . . . 36.25 104.993 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -131.5 162.95 38.47 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.154 0 O-C-N 118.308 -2.745 . . . . 18.54 105.137 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ARG . . . . . 0.467 ' NH1' ' OE2' ' B' ' 35' ' ' GLU . 4.2 mtm180 -105.37 133.84 49.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 121.333 1.879 . . . . 24.89 106.677 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' B' ' 126' ' ' HOH . 8.2 tt0 -98.41 117.24 32.38 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 117.209 2.3 . . . . 23.04 117.209 -176.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -109.77 120.48 42.6 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 117.962 -2.961 . . . . 26.45 108.872 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -93.64 153.75 18.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 124.418 2.056 . . . . 29.99 109.391 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 49.67 43.4 24.32 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 118.926 2.936 . . . . 31.29 118.926 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 39.3 mm -87.12 135.93 24.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 1 O-C-N 113.804 -5.56 . . . . 23.06 113.198 175.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 46.0 tp -80.17 132.05 35.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 123.255 2.752 . . . . 14.19 110.057 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.87 140.73 47.97 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 C-N-CA 128.325 2.65 . . . . 21.89 108.372 178.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -111.88 121.72 45.81 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 125.616 3.826 . . . . 31.62 105.255 167.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 64.4 mt -108.98 116.68 52.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 115.06 -2.4 . . . . 23.69 107.71 -176.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 42.46 55.63 4.04 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 126.678 3.132 . . . . 41.6 109.203 -174.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.68 50.54 7.05 Favored Glycine 0 N--CA 1.43 -1.744 1 CA-C-O 113.046 -4.197 . . . . 36.57 113.623 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HIS . . . . . . . . . . . . 0.349 21.5 m80 -129.53 142.81 50.68 Favored 'General case' 0 N--CA 1.432 -1.344 2 CA-C-N 128.181 5.99 . . . . 32.49 103.919 170.428 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -104.12 140.71 37.41 Favored 'General case' 0 C--O 1.253 1.265 0 CA-C-N 120.962 1.71 . . . . 33.53 113.98 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -143.8 159.06 43.18 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 115.595 -2.145 . . . . 17.68 105.934 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ILE . . . . . . . . . . . . . 31.0 mt -129.41 135.01 62.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 CA-C-N 124.669 3.395 . . . . 20.34 103.812 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.71 -177.19 42.74 Favored Glycine 0 C--O 1.21 -1.402 0 O-C-N 125.519 1.762 . . . . 12.86 111.36 -175.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . 0.257 9.7 m -82.33 140.42 33.56 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 103.57 -2.752 . . . . 21.24 103.57 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' VAL . . . . . . . . . . . . . 18.6 t -133.19 121.17 42.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 127.786 3.179 . . . . 17.37 104.976 -176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 70.2 mt -96.55 138.21 34.47 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-O 113.318 -3.229 . . . . 15.66 107.635 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 97.2 t -124.53 112.7 33.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.638 0 CA-C-N 123.419 2.827 . . . . 20.3 109.992 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.14 -165.16 26.06 Favored Glycine 0 N--CA 1.448 -0.519 0 O-C-N 117.577 -3.202 . . . . 17.67 111.113 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.05 38.25 0.07 OUTLIER 'Trans proline' 0 C--O 1.246 0.922 0 N-CA-C 121.662 3.678 . . . . 17.61 121.662 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 9.7 t -81.15 144.77 54.97 Favored Pre-proline 0 C--N 1.314 -0.941 0 O-C-N 118.258 -2.776 . . . . 16.15 112.365 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -62.97 -40.37 34.96 Favored 'Trans proline' 0 C--O 1.255 1.332 0 C-N-CA 122.719 2.279 . . . . 20.88 117.143 176.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASN . . . . . 0.52 ' OD1' ' C7 ' ' A' ' 100' ' ' U0E . 33.6 m120 -126.27 171.49 10.89 Favored 'General case' 0 C--O 1.203 -1.375 0 O-C-N 116.69 -3.756 . . . . 34.98 107.902 179.5 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -89.06 131.31 35.28 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 115.358 -2.258 . . . . 14.87 106.028 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . 0.27 21.2 mt -120.34 132.8 68.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.777 0 CA-C-N 121.883 2.129 . . . . 13.08 109.918 -176.74 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mm -99.78 124.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 102.707 -3.072 . . . . 11.68 102.707 170.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . -111.47 -170.87 18.99 Favored Glycine 0 CA--C 1.493 -1.299 0 CA-C-O 115.643 -2.754 . . . . 8.75 108.719 -169.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -64.26 -26.72 68.62 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.949 1.374 . . . . 13.91 113.951 -178.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -57.3 -39.35 75.57 Favored 'General case' 0 C--O 1.211 -0.941 0 O-C-N 116.778 -3.701 . . . . 14.14 111.572 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.14 -35.3 13.25 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 116.616 -3.802 . . . . 14.27 112.285 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 63.5 mt -58.56 -33.82 70.35 Favored 'General case' 0 C--N 1.324 -0.52 1 O-C-N 116.274 -4.016 . . . . 12.46 113.046 176.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 43.9 p -72.84 -24.5 60.9 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 119.266 -2.146 . . . . 18.09 107.518 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -72.27 -39.78 68.12 Favored 'General case' 0 CA--C 1.497 -1.074 0 O-C-N 119.677 -1.889 . . . . 29.34 115.512 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.3 pt -87.01 11.1 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 119.26 -2.15 . . . . 18.21 113.43 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 73.28 28.93 65.1 Favored Glycine 0 N--CA 1.43 -1.743 0 CA-C-O 117.574 -1.681 . . . . 16.83 116.346 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 41.4 t -81.07 130.8 35.18 Favored 'General case' 0 C--O 1.255 1.383 0 CA-C-N 121.168 2.484 . . . . 21.06 113.585 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 74.5 p -123.34 164.79 18.13 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-O 128.102 3.811 . . . . 16.89 112.783 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.0 tp -111.22 126.79 55.25 Favored 'General case' 0 C--O 1.196 -1.738 0 N-CA-C 104.465 -2.421 . . . . 20.19 104.465 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . 0.479 ' ND2' ' OD1' ' A' ' 98' ' ' ASN 0.38 15.0 m-80 -119.88 127.5 52.78 Favored 'General case' 0 N--CA 1.401 -2.88 0 C-N-CA 130.638 3.575 . . . . 35.48 117.955 175.774 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' PHE . . . . . . . . . . . . . 38.5 p90 . . . . . 0 CA--C 1.503 -0.843 1 O-C-N 129.319 4.137 . . . . 25.67 109.137 171.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' U0E . . . . . 0.63 ' C8 ' ' C16' ' A' ' 101' ' ' U0E . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' U0E . . . . . 0.664 ' C9 ' ' CG ' ' A' ' 81' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . 0.541 ' O ' ' NE ' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . 0.763 ' O ' ' SG ' ' A' ' 67' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . 0.52 ' O ' ' N ' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . 0.49 ' O ' ' CE ' ' A' ' 46' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . 0.428 ' O ' ' NE2' ' B' ' 58' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo . . . . . 0 N--CA 1.435 -1.964 0 CA-C-O 121.855 0.69 . . . . 29.1 111.275 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -98.19 120.97 39.53 Favored 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 104.972 -2.233 . . . . 39.87 104.972 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 58.4 mt -112.3 127.85 69.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 125.997 2.808 . . . . 22.66 104.946 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.259 28.4 p -97.24 159.43 14.92 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 103.512 -2.773 . . . . 19.31 103.512 179.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -107.17 15.57 25.01 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 112.183 -2.281 . . . . 16.46 115.299 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -69.22 -21.81 63.91 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 117.899 -1.52 . . . . 15.69 109.383 173.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -123.35 156.93 34.4 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 112.267 -3.73 . . . . 33.38 107.527 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . 0.712 HH12 HN81 ' A' ' 100' ' ' U0E . 31.7 mtt180 -55.67 141.2 65.55 Favored Pre-proline 0 N--CA 1.488 1.431 1 CA-C-N 127.188 4.54 . . . . 35.02 110.0 174.808 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . 0.502 ' HD2' ' CD2' ' A' ' 23' ' ' LEU . 44.2 Cg_endo -87.62 89.99 0.54 Allowed 'Trans proline' 0 C--O 1.226 -0.087 0 N-CA-C 108.435 -1.409 . . . . 15.7 108.435 -177.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.4 mt -105.35 145.13 31.17 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 124.074 0.95 . . . . 19.22 110.22 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.359 0.4 OUTLIER -144.43 153.91 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.297 0 C-N-CA 113.109 -3.436 . . . . 14.89 107.844 -171.425 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 88.4 m -85.13 130.06 34.68 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 126.205 2.907 . . . . 20.06 108.832 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.3 pt -116.12 146.17 20.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 O-C-N 119.236 -2.165 . . . . 14.36 111.93 168.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -105.88 117.03 32.97 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.35 -2.833 . . . . 25.15 103.35 167.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 tt -135.46 121.69 32.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.163 -1.421 . . . . 16.09 107.163 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.8 41.36 93.96 Favored Glycine 0 N--CA 1.434 -1.466 0 O-C-N 121.189 -0.944 . . . . 15.54 115.098 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.46 81.18 Favored Glycine 0 C--O 1.217 -0.911 0 C-N-CA 124.23 0.919 . . . . 17.2 114.28 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -135.69 137.94 42.28 Favored 'General case' 0 C--N 1.304 -1.402 1 O-C-N 114.672 -5.017 . . . . 17.26 108.037 -168.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.5 mt -95.77 133.04 40.36 Favored 'General case' 0 C--O 1.216 -0.679 0 O-C-N 125.561 1.788 . . . . 11.85 107.746 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -141.04 162.38 35.61 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.13 0.972 . . . . 19.02 111.265 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -107.66 145.44 33.35 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.621 -1.992 . . . . 24.99 105.621 171.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -147.45 153.67 39.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.818 -1.179 . . . . 10.09 107.818 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.502 ' CD2' ' HD2' ' A' ' 9' ' ' PRO 0.296 0.4 OUTLIER -94.33 135.5 35.67 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 113.224 -1.807 . . . . 16.26 109.94 -179.837 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.2 110.68 18.72 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 104.839 -2.282 . . . . 14.15 104.839 -179.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -122.0 99.55 6.5 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 124.245 1.974 . . . . 9.72 116.263 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.443 HG21 HD22 ' A' ' 97' ' ' LEU . 34.8 p -70.18 -8.93 53.82 Favored 'General case' 0 CA--C 1.511 -0.537 1 O-C-N 113.39 -5.819 . . . . 13.48 112.695 177.62 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -95.24 -0.86 63.0 Favored Glycine 0 C--N 1.317 -0.526 0 O-C-N 120.205 -1.559 . . . . 11.99 112.61 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HA ' H191 ' A' ' 101' ' ' U0E . . . -107.1 126.93 53.0 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 120.46 -1.611 . . . . 9.6 107.254 -179.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -79.54 -24.4 42.2 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 113.183 -3.294 . . . . 18.44 108.768 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.4 173.65 7.52 Favored 'General case' 0 N--CA 1.433 -1.292 1 O-C-N 130.252 4.72 . . . . 18.9 112.798 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.0 m -108.84 121.84 45.93 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 128.7 2.8 . . . . 11.14 105.636 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 76' ' ' LEU 0.327 0.2 OUTLIER -133.57 130.07 56.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 105.594 -2.002 . . . . 13.81 105.594 -175.709 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.8 mt -116.09 150.86 36.66 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-O 114.723 -2.56 . . . . 19.42 107.19 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.66 160.75 16.25 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.033 1.873 . . . . 36.94 106.07 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' HOH . 14.9 tp10 -43.06 127.85 4.31 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 127.486 3.517 . . . . 37.13 114.935 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.0 ptm -150.84 172.31 15.83 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.88 -1.963 . . . . 28.47 111.519 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 p -100.41 114.17 27.51 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 128.832 3.833 . . . . 30.63 107.441 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.416 HD12 ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -120.78 136.54 25.54 Favored Pre-proline 0 N--CA 1.472 0.626 0 CA-C-N 111.029 -2.805 . . . . 30.96 104.647 178.722 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD2' HD12 ' A' ' 38' ' ' LEU . 96.3 Cg_endo -70.46 145.89 54.35 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 N-CA-C 107.838 -1.639 . . . . 31.97 107.838 172.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.06 -169.71 13.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 121.368 3.307 . . . . 38.17 121.368 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER -97.37 155.92 16.68 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 112.057 -2.071 . . . . 49.04 107.58 179.378 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CE3' ' HG2' ' A' ' 57' ' ' ARG . 59.2 p-90 -152.08 141.9 21.98 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 125.432 1.708 . . . . 40.02 114.974 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -97.58 140.69 22.14 Favored Pre-proline 0 N--CA 1.471 0.607 0 O-C-N 119.334 -2.104 . . . . 46.48 105.509 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -67.5 147.52 77.16 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 124.446 3.431 . . . . 34.1 111.02 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.04 164.54 25.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 124.937 2.303 . . . . 36.16 109.601 175.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MET . . . . . 0.519 ' HA ' ' O ' ' A' ' 54' ' ' ILE . 20.7 mtm -129.27 128.44 43.23 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 131.04 3.736 . . . . 48.26 107.813 -175.159 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.581 HD11 HD11 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -117.96 162.22 16.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 N-CA-C 106.558 -1.645 . . . . 26.64 106.558 -178.373 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -120.42 147.66 17.78 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 117.521 -2.276 . . . . 23.81 109.413 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.985 ' HA3' HG22 ' B' ' 50' ' ' ILE . . . -148.13 -149.46 4.97 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 104.76 -3.336 . . . . 21.12 104.76 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . 0.749 HD12 ' HD2' ' B' ' 81' ' ' PRO . 1.2 tp -75.58 -45.45 39.18 Favored 'Isoleucine or valine' 0 C--O 1.249 1.071 1 CA-C-O 111.195 -4.241 . . . . 23.34 112.7 -171.265 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -105.35 20.17 38.16 Favored Glycine 0 N--CA 1.477 1.433 1 CA-C-N 131.355 6.434 . . . . 21.39 112.285 -172.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.44 -145.86 17.63 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 124.533 2.185 . . . . 21.23 118.329 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.72 136.61 51.78 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 126.982 3.277 . . . . 26.92 106.154 -167.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . 0.581 HD11 HD11 ' A' ' 47' ' ' ILE . 6.5 pt -112.9 155.71 14.06 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.115 -1.857 . . . . 21.91 108.091 171.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.29 123.59 39.98 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 127.794 2.438 . . . . 34.78 105.209 171.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 18.6 m -126.28 174.3 10.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 O-C-N 124.067 0.854 . . . . 20.04 109.949 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.437 ' HG2' ' CE3' ' A' ' 42' ' ' TRP 0.347 5.9 mtt180 -112.5 130.72 55.9 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 114.125 -2.845 . . . . 38.22 106.9 173.063 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -98.55 155.49 17.26 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 113.305 -3.358 . . . . 24.79 110.681 174.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . 0.721 ' HB3' HD11 ' A' ' 62' ' ' ILE . 84.4 m-85 -133.72 133.07 41.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 129.124 2.97 . . . . 23.0 104.235 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -110.43 148.86 31.19 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 126.026 2.079 . . . . 34.18 107.645 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.432 ' OE1' HG12 ' A' ' 72' ' ' ILE . 8.0 mm-40 62.69 40.77 9.85 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 124.71 2.195 . . . . 35.76 113.317 174.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . 0.721 HD11 ' HB3' ' A' ' 59' ' ' TYR . 18.2 mm -93.37 128.81 44.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 O-C-N 119.527 -1.983 . . . . 17.41 107.583 173.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -78.9 129.65 34.77 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 127.215 3.388 . . . . 13.06 111.118 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 4.9 tt -136.53 129.84 46.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 126.316 2.96 . . . . 15.73 104.126 -178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -105.91 121.79 44.8 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 127.345 3.45 . . . . 26.79 106.344 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.8 mt -118.47 113.33 41.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 O-C-N 118.098 -2.876 . . . . 21.59 109.972 -173.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 48.26 59.71 4.1 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 127.387 2.929 . . . . 40.93 109.377 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.85 -24.08 0.67 Allowed Glycine 0 C--O 1.253 1.33 1 O-C-N 115.643 -4.411 . . . . 30.53 115.502 -178.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 11.5 m80 -85.88 136.13 33.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 120.09 1.945 . . . . 33.55 107.723 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.62 137.34 32.42 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 126.087 1.755 . . . . 29.57 114.292 176.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -144.95 158.98 43.63 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 119.053 -2.28 . . . . 16.66 105.53 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 0.432 HG12 ' OE1' ' A' ' 61' ' ' GLN 0.284 1.9 tt -135.01 131.69 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 103.785 -2.672 . . . . 20.85 103.785 179.442 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.84 -166.7 32.44 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-O 127.101 3.612 . . . . 15.41 112.147 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 59' ' ' TYR 0.307 61.0 m -86.55 133.14 33.75 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 118.666 -2.667 . . . . 21.5 111.783 175.876 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.9 t -122.92 128.1 75.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 104.387 -2.449 . . . . 18.09 104.387 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . 0.619 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 9.3 mt -93.73 127.56 39.51 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 121.3 1.864 . . . . 16.83 106.376 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 65.8 t -110.86 130.1 64.87 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-O 115.21 -2.329 . . . . 18.74 105.674 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 176.87 -163.37 32.24 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 121.598 1.999 . . . . 16.85 109.253 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -85.92 52.49 3.02 Favored 'Trans proline' 0 C--O 1.261 1.665 0 N-CA-C 120.869 3.373 . . . . 18.47 120.869 -175.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . 0.416 ' OG1' HD11 ' B' ' 50' ' ' ILE . 3.2 t -73.56 151.64 89.42 Favored Pre-proline 0 C--N 1.324 -0.529 0 O-C-N 118.772 -2.455 . . . . 17.51 105.214 173.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . 0.958 ' CG ' ' H91' ' A' ' 101' ' ' U0E . 98.1 Cg_endo -72.58 -23.54 19.74 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.723 1.615 . . . . 20.81 111.737 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . 0.835 ' HB2' ' H81' ' A' ' 101' ' ' U0E 0.306 1.9 m120 -141.05 154.07 45.8 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 118.075 -2.891 . . . . 29.44 113.417 -179.459 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -67.58 126.5 29.54 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.058 -1.83 . . . . 12.81 106.058 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . 0.644 HD11 H102 ' A' ' 101' ' ' U0E . 3.6 mt -119.54 119.83 61.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 C-N-CA 129.47 3.108 . . . . 16.86 111.355 -174.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.25 109.35 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 101.681 -3.451 . . . . 9.35 101.681 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.96 -173.19 34.5 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 107.411 -2.276 . . . . 8.85 107.411 -177.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 29.3 mtm105 -65.13 -22.05 66.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 112.648 -3.549 . . . . 12.84 112.588 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -63.22 -25.12 68.18 Favored 'General case' 0 C--N 1.309 -1.163 1 CA-C-N 126.76 4.346 . . . . 13.18 111.784 171.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.6 mt -106.02 -31.94 8.52 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 121.572 1.987 . . . . 13.19 110.228 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 67.0 mt -56.96 -36.99 70.93 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 118.627 0.649 . . . . 10.59 111.318 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 25.5 p -72.43 -20.1 61.47 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 116.44 -3.913 . . . . 15.55 110.687 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -76.41 -34.84 58.82 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 122.543 2.429 . . . . 24.2 116.53 177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.25 6.84 3.89 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 CA-C-O 125.215 2.436 . . . . 18.17 111.724 174.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.62 48.45 10.44 Favored Glycine 0 N--CA 1.43 -1.756 2 C-N-CA 132.908 5.051 . . . . 17.83 110.736 171.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' CYS . . . . . 0.853 ' HB2' ' HB3' ' B' ' 99' ' ' PHE 0.355 0.0 OUTLIER -101.2 144.09 30.49 Favored 'General case' 0 N--CA 1.498 1.951 1 C-N-CA 110.776 -4.37 . . . . 22.93 108.915 -166.663 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.7 p -128.03 178.96 5.84 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 123.534 1.635 . . . . 17.07 110.864 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 26' ' ' THR 0.308 14.7 tp -129.74 131.83 46.4 Favored 'General case' 0 C--N 1.295 -1.79 1 N-CA-C 100.144 -4.021 . . . . 20.82 100.144 -177.549 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.826 HD22 ' HG3' ' B' ' 2' ' ' GLN . 0.1 OUTLIER -139.85 141.46 36.65 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 126.295 2.95 . . . . 32.26 108.983 -174.91 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . 0.454 ' OXT' ' HD2' ' B' ' 1' ' ' PRO . 32.2 p90 . . . . . 0 C--N 1.315 -0.896 0 N-CA-C 103.924 -2.621 . . . . 28.32 103.924 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PRO . . . . . 0.454 ' HD2' ' OXT' ' A' ' 99' ' ' PHE . 7.4 Cg_endo . . . . . 0 N--CA 1.425 -2.515 0 CA-C-O 128.514 3.464 . . . . 31.09 114.248 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLN . . . . . 0.826 ' HG3' HD22 ' A' ' 98' ' ' ASN . 28.5 tt0 -117.75 121.93 42.13 Favored 'General case' 0 C--O 1.243 0.721 1 CA-C-N 107.303 -4.499 . . . . 35.37 104.698 170.867 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 mt -110.04 121.92 63.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.724 -1.584 . . . . 22.39 106.724 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 73.9 p -93.87 157.94 15.89 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.692 -1.225 . . . . 23.9 107.692 172.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.77 15.73 28.07 Favored 'General case' 0 CA--C 1.493 -1.239 0 N-CA-C 119.46 3.133 . . . . 15.38 119.46 -167.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -61.01 -29.96 70.02 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 126.408 3.004 . . . . 17.66 114.536 166.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -122.73 156.74 33.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 117.382 -3.324 . . . . 29.84 104.636 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -49.21 128.99 16.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 120.15 -1.594 . . . . 45.3 109.964 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -71.94 86.85 0.89 Allowed 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 123.067 2.511 . . . . 12.67 111.519 173.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . 0.26 12.1 mt -107.75 141.53 39.14 Favored 'General case' 0 N--CA 1.44 -0.956 1 O-C-N 115.904 -4.247 . . . . 17.9 108.911 -169.868 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' B' ' 67' ' ' CYS 0.398 0.4 OUTLIER -145.88 154.37 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 1 C-N-CA 110.469 -4.493 . . . . 12.45 105.93 -169.614 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -82.15 130.45 35.09 Favored 'General case' 0 C--N 1.304 -1.393 1 CA-C-O 129.411 4.434 . . . . 20.79 112.357 170.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' B' ' 65' ' ' GLU . 12.1 pt -123.24 153.79 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-O 127.204 3.383 . . . . 14.13 107.661 172.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -123.42 122.57 38.6 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 101.717 -3.438 . . . . 28.79 101.717 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ILE . . . . . 0.477 ' O ' ' HB2' ' B' ' 18' ' ' GLN . 13.0 tt -151.4 124.57 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 O-C-N 128.373 3.546 . . . . 16.55 108.185 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.05 38.25 95.74 Favored Glycine 0 C--O 1.22 -0.724 0 CA-C-O 123.341 1.523 . . . . 16.67 115.46 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.26 -5.12 81.72 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.013 -1.093 . . . . 20.42 110.958 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' B' ' 15' ' ' ILE . 37.2 mt-30 -110.65 140.87 44.6 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 119.494 3.146 . . . . 17.81 119.494 -172.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.92 131.52 37.18 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 126.865 2.603 . . . . 12.58 109.204 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LYS . . . . . 0.548 ' HE3' ' SD ' ' B' ' 36' ' ' MET . 43.4 mttm -144.59 168.4 20.24 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.833 -0.603 . . . . 19.85 111.375 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -114.29 134.39 54.98 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 116.074 -1.917 . . . . 24.91 106.198 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -134.92 149.77 50.32 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 119.918 1.235 . . . . 8.38 110.244 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . 0.272 0.3 OUTLIER -85.89 136.6 33.22 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.553 -0.748 . . . . 17.26 112.077 175.865 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.68 116.09 23.02 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 119.076 -2.265 . . . . 11.9 106.433 177.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASP . . . . . 0.475 ' HB3' ' CG2' ' B' ' 84' ' ' ILE . 64.7 t0 -127.36 101.3 6.4 Favored 'General case' 0 CA--C 1.51 -0.595 0 C-N-CA 118.634 -1.227 . . . . 13.09 111.31 -167.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.8 p -70.55 -16.78 62.91 Favored 'General case' 0 CA--C 1.49 -1.362 0 C-N-CA 116.171 -2.212 . . . . 10.75 110.215 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.24 8.91 62.44 Favored Glycine 0 C--O 1.227 -0.316 2 CA-C-N 127.199 4.545 . . . . 12.23 111.785 178.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -116.84 119.03 34.12 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 116.955 -3.674 . . . . 10.37 107.429 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -60.26 -41.09 92.53 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 116.783 -3.698 . . . . 15.2 112.354 171.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . 0.553 ' HB2' ' O4 ' ' A' ' 100' ' ' U0E 0.427 65.9 m-20 -112.51 164.61 13.09 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 134.057 4.943 . . . . 17.62 119.099 -176.748 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 26.3 m -104.57 120.2 40.74 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.786 -1.19 . . . . 12.47 107.786 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . 0.73 HG12 HD12 ' B' ' 84' ' ' ILE . 1.9 p -123.36 121.05 61.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 114.688 -1.142 . . . . 14.44 109.543 -175.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . 0.653 HD23 HG13 ' B' ' 75' ' ' VAL . 2.9 mm? -120.54 144.45 48.06 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 127.714 3.626 . . . . 20.16 105.3 -175.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -44.09 149.81 0.32 Allowed 'General case' 0 C--N 1.304 -1.378 0 O-C-N 118.918 -2.364 . . . . 39.85 106.185 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' B' ' 109' ' ' HOH . 0.4 OUTLIER -52.96 116.26 2.27 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 126.702 3.144 . . . . 40.98 113.197 177.704 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 36' ' ' MET . . . . . 0.548 ' SD ' ' HE3' ' B' ' 20' ' ' LYS . 5.4 ptt? -147.47 172.74 13.48 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 118.921 -2.362 . . . . 31.8 111.161 -175.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 71.9 m -81.69 109.72 16.37 Favored 'General case' 0 C--O 1.252 1.231 1 O-C-N 130.226 4.704 . . . . 39.75 113.902 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -134.4 125.52 17.78 Favored Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 115.912 -2.315 . . . . 35.78 106.59 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.23 149.63 81.54 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 125.895 2.524 . . . . 36.9 111.699 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 116.84 -171.59 13.86 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 124.65 2.25 . . . . 38.86 113.675 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -106.93 156.0 19.18 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.348 -1.723 . . . . 55.9 106.348 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . 0.306 32.7 p-90 -147.8 169.04 20.63 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 124.769 1.228 . . . . 37.35 110.264 174.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -119.36 138.23 26.21 Favored Pre-proline 0 C--O 1.215 -0.722 0 O-C-N 126.41 2.319 . . . . 40.54 110.832 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -59.42 140.34 93.77 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.131 -2.68 . . . . 31.13 105.131 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -150.13 169.06 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 101.569 -3.493 . . . . 31.04 101.569 177.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' MET . . . . . . . . . . . . 0.263 30.0 mtt -143.31 136.32 27.83 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 120.936 1.698 . . . . 37.24 109.835 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . 0.438 HG21 ' N3 ' ' A' ' 100' ' ' U0E . 17.4 pt -124.81 160.01 30.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.305 0 CA-C-O 126.582 3.087 . . . . 23.2 112.405 173.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -114.65 158.61 14.21 Favored Glycine 0 C--O 1.217 -0.948 1 CA-C-O 128.025 4.125 . . . . 18.85 116.3 174.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -154.89 -151.12 5.74 Favored Glycine 0 C--O 1.214 -1.131 0 N-CA-C 103.896 -3.682 . . . . 16.34 103.896 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . 0.985 HG22 ' HA3' ' A' ' 49' ' ' GLY 0.492 0.0 OUTLIER -76.06 138.01 21.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 120.516 -1.579 . . . . 23.65 106.966 179.993 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.32 -26.07 19.35 Favored Glycine 0 C--O 1.246 0.875 2 O-C-N 114.804 -4.935 . . . . 25.69 109.742 -176.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.84 -152.0 21.54 Favored Glycine 0 C--N 1.337 0.596 1 CA-C-N 125.181 4.49 . . . . 23.32 118.577 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . 0.28 0.0 OUTLIER -110.99 140.61 45.37 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 112.706 -3.521 . . . . 32.55 114.635 -173.582 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . 0.442 HG13 HG13 ' B' ' 56' ' ' VAL . 29.2 pt -123.5 158.61 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 114.253 -2.979 . . . . 21.95 108.007 169.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -96.12 126.96 41.71 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 104.993 -2.225 . . . . 36.25 104.993 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' VAL . . . . . 0.442 HG13 HG13 ' B' ' 54' ' ' ILE . 28.7 m -131.5 162.95 38.47 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.154 0 O-C-N 118.308 -2.745 . . . . 18.54 105.137 -178.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ARG . . . . . 0.467 ' NH1' ' OE2' ' B' ' 35' ' ' GLU . 4.2 mtm180 -105.37 133.84 49.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 121.333 1.879 . . . . 24.89 106.677 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -98.41 117.24 32.38 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 117.209 2.3 . . . . 23.04 117.209 -176.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -109.77 120.48 42.6 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 117.962 -2.961 . . . . 26.45 108.872 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -93.64 153.75 18.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 124.418 2.056 . . . . 29.99 109.391 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 49.67 43.4 24.32 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 118.926 2.936 . . . . 31.29 118.926 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 39.3 mm -87.12 135.93 24.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 1 O-C-N 113.804 -5.56 . . . . 23.06 113.198 175.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 46.0 tp -80.17 132.05 35.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 123.255 2.752 . . . . 14.19 110.057 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . 0.519 HD11 ' CG2' ' B' ' 75' ' ' VAL . 1.0 OUTLIER -130.87 140.73 47.97 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 C-N-CA 128.325 2.65 . . . . 21.89 108.372 178.87 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' B' ' 70' ' ' LYS . 22.5 mt-10 -111.88 121.72 45.81 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 125.616 3.826 . . . . 31.62 105.255 167.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ILE . . . . . 0.551 ' HA ' HG22 ' B' ' 13' ' ' ILE . 64.4 mt -108.98 116.68 52.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 115.06 -2.4 . . . . 23.69 107.71 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' B' ' 11' ' ' VAL . 0.5 OUTLIER 42.46 55.63 4.04 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 126.678 3.132 . . . . 41.6 109.203 -174.161 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.68 50.54 7.05 Favored Glycine 0 N--CA 1.43 -1.744 1 CA-C-O 113.046 -4.197 . . . . 36.57 113.623 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HIS . . . . . 0.473 ' O ' ' HA ' ' B' ' 65' ' ' GLU 0.349 21.5 m80 -129.53 142.81 50.68 Favored 'General case' 0 N--CA 1.432 -1.344 2 CA-C-N 128.181 5.99 . . . . 32.49 103.919 170.428 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.64 ' HG2' ' HG2' ' B' ' 65' ' ' GLU . 0.7 OUTLIER -104.12 140.71 37.41 Favored 'General case' 0 C--O 1.253 1.265 0 CA-C-N 120.962 1.71 . . . . 33.53 113.98 -177.432 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -143.8 159.06 43.18 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 115.595 -2.145 . . . . 17.68 105.934 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ILE . . . . . . . . . . . . . 31.0 mt -129.41 135.01 62.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 CA-C-N 124.669 3.395 . . . . 20.34 103.812 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.71 -177.19 42.74 Favored Glycine 0 C--O 1.21 -1.402 0 O-C-N 125.519 1.762 . . . . 12.86 111.36 -175.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . 0.257 9.7 m -82.33 140.42 33.56 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 103.57 -2.752 . . . . 21.24 103.57 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' VAL . . . . . 0.653 HG13 HD23 ' B' ' 33' ' ' LEU . 18.6 t -133.19 121.17 42.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 127.786 3.179 . . . . 17.37 104.976 -176.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 70.2 mt -96.55 138.21 34.47 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-O 113.318 -3.229 . . . . 15.66 107.635 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 97.2 t -124.53 112.7 33.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.638 0 CA-C-N 123.419 2.827 . . . . 20.3 109.992 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.14 -165.16 26.06 Favored Glycine 0 N--CA 1.448 -0.519 0 O-C-N 117.577 -3.202 . . . . 17.67 111.113 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.05 38.25 0.07 OUTLIER 'Trans proline' 0 C--O 1.246 0.922 0 N-CA-C 121.662 3.678 . . . . 17.61 121.662 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' THR . . . . . 0.711 ' OG1' HD11 ' A' ' 50' ' ' ILE . 9.7 t -81.15 144.77 54.97 Favored Pre-proline 0 C--N 1.314 -0.941 0 O-C-N 118.258 -2.776 . . . . 16.15 112.365 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PRO . . . . . 0.967 ' HG2' ' H91' ' A' ' 100' ' ' U0E . 9.6 Cg_endo -62.97 -40.37 34.96 Favored 'Trans proline' 0 C--O 1.255 1.332 0 C-N-CA 122.719 2.279 . . . . 20.88 117.143 176.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASN . . . . . 0.711 ' OD1' ' H71' ' A' ' 100' ' ' U0E . 33.6 m120 -126.27 171.49 10.89 Favored 'General case' 0 C--O 1.203 -1.375 0 O-C-N 116.69 -3.756 . . . . 34.98 107.902 179.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -89.06 131.31 35.28 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 115.358 -2.258 . . . . 14.87 106.028 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . 0.73 HD12 HG12 ' B' ' 32' ' ' VAL 0.27 21.2 mt -120.34 132.8 68.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.777 0 CA-C-N 121.883 2.129 . . . . 13.08 109.918 -176.74 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mm -99.78 124.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 102.707 -3.072 . . . . 11.68 102.707 170.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' B' ' 90' ' ' LEU . . . -111.47 -170.87 18.99 Favored Glycine 0 CA--C 1.493 -1.299 0 CA-C-O 115.643 -2.754 . . . . 8.75 108.719 -169.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -64.26 -26.72 68.62 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.949 1.374 . . . . 13.91 113.951 -178.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -57.3 -39.35 75.57 Favored 'General case' 0 C--O 1.211 -0.941 0 O-C-N 116.778 -3.701 . . . . 14.14 111.572 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.14 -35.3 13.25 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 116.616 -3.802 . . . . 14.27 112.285 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 86' ' ' GLY . 63.5 mt -58.56 -33.82 70.35 Favored 'General case' 0 C--N 1.324 -0.52 1 O-C-N 116.274 -4.016 . . . . 12.46 113.046 176.919 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 43.9 p -72.84 -24.5 60.9 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 119.266 -2.146 . . . . 18.09 107.518 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -72.27 -39.78 68.12 Favored 'General case' 0 CA--C 1.497 -1.074 0 O-C-N 119.677 -1.889 . . . . 29.34 115.512 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.3 pt -87.01 11.1 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 119.26 -2.15 . . . . 18.21 113.43 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 73.28 28.93 65.1 Favored Glycine 0 N--CA 1.43 -1.743 0 CA-C-O 117.574 -1.681 . . . . 16.83 116.346 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 41.4 t -81.07 130.8 35.18 Favored 'General case' 0 C--O 1.255 1.383 0 CA-C-N 121.168 2.484 . . . . 21.06 113.585 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 74.5 p -123.34 164.79 18.13 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-O 128.102 3.811 . . . . 16.89 112.783 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.0 tp -111.22 126.79 55.25 Favored 'General case' 0 C--O 1.196 -1.738 0 N-CA-C 104.465 -2.421 . . . . 20.19 104.465 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.401 ' ND2' ' OD1' ' A' ' 98' ' ' ASN 0.38 15.0 m-80 -119.88 127.5 52.78 Favored 'General case' 0 N--CA 1.401 -2.88 0 C-N-CA 130.638 3.575 . . . . 35.48 117.955 175.774 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 99' ' ' PHE . . . . . 0.853 ' HB3' ' HB2' ' A' ' 95' ' ' CYS . 38.5 p90 . . . . . 0 CA--C 1.503 -0.843 1 O-C-N 129.319 4.137 . . . . 25.67 109.137 171.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' U0E . . . . . 0.967 ' H91' ' HG2' ' B' ' 81' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' U0E . . . . . 0.958 ' H91' ' CG ' ' A' ' 81' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . 0.412 ' O ' ' HB2' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . 0.515 ' O ' ' HE3' ' A' ' 46' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . 0.469 ' O ' ' NE2' ' B' ' 18' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . 0.513 ' O ' ' HG2' ' B' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . 0.454 ' O ' ' HB2' ' B' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 134' ' ' HOH . . . . . 0.459 ' O ' ' HG2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo . . . . . 0 N--CA 1.435 -1.964 0 CA-C-O 121.855 0.69 . . . . 29.1 111.275 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -98.19 120.97 39.53 Favored 'General case' 0 C--O 1.211 -0.924 0 N-CA-C 104.972 -2.233 . . . . 39.87 104.972 172.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 58.4 mt -112.3 127.85 69.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.849 0 CA-C-O 125.997 2.808 . . . . 22.66 104.946 -176.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . 0.259 28.4 p -97.24 159.43 14.92 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 103.512 -2.773 . . . . 19.31 103.512 179.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -107.17 15.57 25.01 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 112.183 -2.281 . . . . 16.46 115.299 -169.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -69.22 -21.81 63.91 Favored 'General case' 0 C--N 1.356 0.884 0 C-N-CA 117.899 -1.52 . . . . 15.69 109.383 173.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.35 156.93 34.4 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 112.267 -3.73 . . . . 33.38 107.527 -177.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.712 HH12 HN81 ' A' ' 100' ' ' U0E . 31.7 mtt180 -55.67 141.2 65.55 Favored Pre-proline 0 N--CA 1.488 1.431 1 CA-C-N 127.188 4.54 . . . . 35.02 110.0 174.808 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.502 ' HD2' ' CD2' ' A' ' 23' ' ' LEU . 44.2 Cg_endo -87.62 89.99 0.54 Allowed 'Trans proline' 0 C--O 1.226 -0.087 0 N-CA-C 108.435 -1.409 . . . . 15.7 108.435 -177.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.4 mt -105.35 145.13 31.17 Favored 'General case' 0 N--CA 1.434 -1.229 0 C-N-CA 124.074 0.95 . . . . 19.22 110.22 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.359 0.4 OUTLIER -144.43 153.91 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.297 0 C-N-CA 113.109 -3.436 . . . . 14.89 107.844 -171.425 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 88.4 m -85.13 130.06 34.68 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 126.205 2.907 . . . . 20.06 108.832 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 39.3 pt -116.12 146.17 20.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 O-C-N 119.236 -2.165 . . . . 14.36 111.93 168.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -105.88 117.03 32.97 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 103.35 -2.833 . . . . 25.15 103.35 167.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 tt -135.46 121.69 32.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.163 -1.421 . . . . 16.09 107.163 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 57.8 41.36 93.96 Favored Glycine 0 N--CA 1.434 -1.466 0 O-C-N 121.189 -0.944 . . . . 15.54 115.098 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.87 15.46 81.18 Favored Glycine 0 C--O 1.217 -0.911 0 C-N-CA 124.23 0.919 . . . . 17.2 114.28 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -135.69 137.94 42.28 Favored 'General case' 0 C--N 1.304 -1.402 1 O-C-N 114.672 -5.017 . . . . 17.26 108.037 -168.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.5 mt -95.77 133.04 40.36 Favored 'General case' 0 C--O 1.216 -0.679 0 O-C-N 125.561 1.788 . . . . 11.85 107.746 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -141.04 162.38 35.61 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.13 0.972 . . . . 19.02 111.265 -178.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -107.66 145.44 33.35 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 105.621 -1.992 . . . . 24.99 105.621 171.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -147.45 153.67 39.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.818 -1.179 . . . . 10.09 107.818 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.502 ' CD2' ' HD2' ' A' ' 9' ' ' PRO 0.296 0.4 OUTLIER -94.33 135.5 35.67 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 113.224 -1.807 . . . . 16.26 109.94 -179.837 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.2 110.68 18.72 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 104.839 -2.282 . . . . 14.15 104.839 -179.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 42.3 t0 -122.0 99.55 6.5 Favored 'General case' 0 C--O 1.209 -1.037 0 CA-C-O 124.245 1.974 . . . . 9.72 116.263 -173.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.443 HG21 HD22 ' A' ' 97' ' ' LEU . 34.8 p -70.18 -8.93 53.82 Favored 'General case' 0 CA--C 1.511 -0.537 1 O-C-N 113.39 -5.819 . . . . 13.48 112.695 177.62 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -95.24 -0.86 63.0 Favored Glycine 0 C--N 1.317 -0.526 0 O-C-N 120.205 -1.559 . . . . 11.99 112.61 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HA ' H191 ' A' ' 101' ' ' U0E . . . -107.1 126.93 53.0 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 120.46 -1.611 . . . . 9.6 107.254 -179.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -79.54 -24.4 42.2 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 113.183 -3.294 . . . . 18.44 108.768 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -122.4 173.65 7.52 Favored 'General case' 0 N--CA 1.433 -1.292 1 O-C-N 130.252 4.72 . . . . 18.9 112.798 -177.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 88.0 m -108.84 121.84 45.93 Favored 'General case' 0 N--CA 1.439 -1.025 0 C-N-CA 128.7 2.8 . . . . 11.14 105.636 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.619 ' HA ' ' O ' ' A' ' 76' ' ' LEU 0.327 0.2 OUTLIER -133.57 130.07 56.26 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 105.594 -2.002 . . . . 13.81 105.594 -175.709 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.8 mt -116.09 150.86 36.66 Favored 'General case' 0 CA--C 1.497 -1.096 0 CA-C-O 114.723 -2.56 . . . . 19.42 107.19 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -63.66 160.75 16.25 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.033 1.873 . . . . 36.94 106.07 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 130' ' ' HOH . 14.9 tp10 -43.06 127.85 4.31 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 127.486 3.517 . . . . 37.13 114.935 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 28.0 ptm -150.84 172.31 15.83 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 112.88 -1.963 . . . . 28.47 111.519 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.1 p -100.41 114.17 27.51 Favored 'General case' 0 N--CA 1.451 -0.399 0 O-C-N 128.832 3.833 . . . . 30.63 107.441 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.416 HD12 ' HD2' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -120.78 136.54 25.54 Favored Pre-proline 0 N--CA 1.472 0.626 0 CA-C-N 111.029 -2.805 . . . . 30.96 104.647 178.722 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.416 ' HD2' HD12 ' A' ' 38' ' ' LEU . 96.3 Cg_endo -70.46 145.89 54.35 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 N-CA-C 107.838 -1.639 . . . . 31.97 107.838 172.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.06 -169.71 13.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 121.368 3.307 . . . . 38.17 121.368 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . 0.262 0.0 OUTLIER -97.37 155.92 16.68 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 112.057 -2.071 . . . . 49.04 107.58 179.378 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CE3' ' HG2' ' A' ' 57' ' ' ARG . 59.2 p-90 -152.08 141.9 21.98 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 125.432 1.708 . . . . 40.02 114.974 176.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -97.58 140.69 22.14 Favored Pre-proline 0 N--CA 1.471 0.607 0 O-C-N 119.334 -2.104 . . . . 46.48 105.509 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -67.5 147.52 77.16 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 124.446 3.431 . . . . 34.1 111.02 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.04 164.54 25.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 124.937 2.303 . . . . 36.16 109.601 175.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MET . . . . . 0.519 ' HA ' ' O ' ' A' ' 54' ' ' ILE . 20.7 mtm -129.27 128.44 43.23 Favored 'General case' 0 N--CA 1.435 -1.207 0 C-N-CA 131.04 3.736 . . . . 48.26 107.813 -175.159 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.581 HD11 HD11 ' A' ' 54' ' ' ILE . 0.3 OUTLIER -117.96 162.22 16.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 N-CA-C 106.558 -1.645 . . . . 26.64 106.558 -178.373 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -120.42 147.66 17.78 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 117.521 -2.276 . . . . 23.81 109.413 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.985 ' HA3' HG22 ' B' ' 50' ' ' ILE . . . -148.13 -149.46 4.97 Favored Glycine 0 CA--C 1.532 1.144 0 N-CA-C 104.76 -3.336 . . . . 21.12 104.76 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.749 HD12 ' HD2' ' B' ' 81' ' ' PRO . 1.2 tp -75.58 -45.45 39.18 Favored 'Isoleucine or valine' 0 C--O 1.249 1.071 1 CA-C-O 111.195 -4.241 . . . . 23.34 112.7 -171.265 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -105.35 20.17 38.16 Favored Glycine 0 N--CA 1.477 1.433 1 CA-C-N 131.355 6.434 . . . . 21.39 112.285 -172.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.44 -145.86 17.63 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 124.533 2.185 . . . . 21.23 118.329 -176.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.72 136.61 51.78 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 126.982 3.277 . . . . 26.92 106.154 -167.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.581 HD11 HD11 ' A' ' 47' ' ' ILE . 6.5 pt -112.9 155.71 14.06 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 CA-C-N 113.115 -1.857 . . . . 21.91 108.091 171.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.29 123.59 39.98 Favored 'General case' 0 N--CA 1.435 -1.182 0 C-N-CA 127.794 2.438 . . . . 34.78 105.209 171.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 18.6 m -126.28 174.3 10.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 O-C-N 124.067 0.854 . . . . 20.04 109.949 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.437 ' HG2' ' CE3' ' A' ' 42' ' ' TRP 0.347 5.9 mtt180 -112.5 130.72 55.9 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 114.125 -2.845 . . . . 38.22 106.9 173.063 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -98.55 155.49 17.26 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 113.305 -3.358 . . . . 24.79 110.681 174.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.721 ' HB3' HD11 ' A' ' 62' ' ' ILE . 84.4 m-85 -133.72 133.07 41.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 129.124 2.97 . . . . 23.0 104.235 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -110.43 148.86 31.19 Favored 'General case' 0 C--N 1.317 -0.847 0 O-C-N 126.026 2.079 . . . . 34.18 107.645 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.578 ' NE2' HG12 ' A' ' 72' ' ' ILE . 0.6 OUTLIER 62.69 40.77 9.85 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 124.71 2.195 . . . . 35.76 113.317 174.594 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.721 HD11 ' HB3' ' A' ' 59' ' ' TYR . 18.2 mm -93.37 128.81 44.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 O-C-N 119.527 -1.983 . . . . 17.41 107.583 173.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 tp -78.9 129.65 34.77 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-O 127.215 3.388 . . . . 13.06 111.118 172.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 4.9 tt -136.53 129.84 46.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-O 126.316 2.96 . . . . 15.73 104.126 -178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -105.91 121.79 44.8 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 127.345 3.45 . . . . 26.79 106.344 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.8 mt -118.47 113.33 41.55 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 O-C-N 118.098 -2.876 . . . . 21.59 109.972 -173.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 48.26 59.71 4.1 Favored 'General case' 0 C--O 1.246 0.915 0 O-C-N 127.387 2.929 . . . . 40.93 109.377 -174.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 71.85 -24.08 0.67 Allowed Glycine 0 C--O 1.253 1.33 1 O-C-N 115.643 -4.411 . . . . 30.53 115.502 -178.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 11.5 m80 -85.88 136.13 33.42 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 120.09 1.945 . . . . 33.55 107.723 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.62 137.34 32.42 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 126.087 1.755 . . . . 29.57 114.292 176.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -144.95 158.98 43.63 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 119.053 -2.28 . . . . 16.66 105.53 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.578 HG12 ' NE2' ' A' ' 61' ' ' GLN 0.284 1.9 tt -135.01 131.69 52.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 N-CA-C 103.785 -2.672 . . . . 20.85 103.785 179.442 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.84 -166.7 32.44 Favored Glycine 0 C--O 1.213 -1.212 0 CA-C-O 127.101 3.612 . . . . 15.41 112.147 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 59' ' ' TYR 0.307 61.0 m -86.55 133.14 33.75 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 118.666 -2.667 . . . . 21.5 111.783 175.876 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 2.9 t -122.92 128.1 75.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 N-CA-C 104.387 -2.449 . . . . 18.09 104.387 -179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.619 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 9.3 mt -93.73 127.56 39.51 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 121.3 1.864 . . . . 16.83 106.376 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 65.8 t -110.86 130.1 64.87 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-O 115.21 -2.329 . . . . 18.74 105.674 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 176.87 -163.37 32.24 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 121.598 1.999 . . . . 16.85 109.253 -179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -85.92 52.49 3.02 Favored 'Trans proline' 0 C--O 1.261 1.665 0 N-CA-C 120.869 3.373 . . . . 18.47 120.869 -175.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . 0.416 ' OG1' HD11 ' B' ' 50' ' ' ILE . 3.2 t -73.56 151.64 89.42 Favored Pre-proline 0 C--N 1.324 -0.529 0 O-C-N 118.772 -2.455 . . . . 17.51 105.214 173.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.958 ' CG ' ' H91' ' A' ' 101' ' ' U0E . 98.1 Cg_endo -72.58 -23.54 19.74 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 121.723 1.615 . . . . 20.81 111.737 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.835 ' HB2' ' H81' ' A' ' 101' ' ' U0E 0.306 1.9 m120 -141.05 154.07 45.8 Favored 'General case' 0 N--CA 1.434 -1.232 0 O-C-N 118.075 -2.891 . . . . 29.44 113.417 -179.459 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -67.58 126.5 29.54 Favored 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 106.058 -1.83 . . . . 12.81 106.058 173.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.644 HD11 H102 ' A' ' 101' ' ' U0E . 3.6 mt -119.54 119.83 61.69 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.369 0 C-N-CA 129.47 3.108 . . . . 16.86 111.355 -174.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.25 109.35 24.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.796 0 N-CA-C 101.681 -3.451 . . . . 9.35 101.681 175.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -96.96 -173.19 34.5 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 107.411 -2.276 . . . . 8.85 107.411 -177.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 29.3 mtm105 -65.13 -22.05 66.88 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 112.648 -3.549 . . . . 12.84 112.588 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -63.22 -25.12 68.18 Favored 'General case' 0 C--N 1.309 -1.163 1 CA-C-N 126.76 4.346 . . . . 13.18 111.784 171.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 39.6 mt -106.02 -31.94 8.52 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 121.572 1.987 . . . . 13.19 110.228 178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 67.0 mt -56.96 -36.99 70.93 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 118.627 0.649 . . . . 10.59 111.318 178.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 25.5 p -72.43 -20.1 61.47 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 116.44 -3.913 . . . . 15.55 110.687 176.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.517 HE22 ' H ' ' A' ' 72' ' ' ILE . 15.6 mt-30 -76.41 -34.84 58.82 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 122.543 2.429 . . . . 24.2 116.53 177.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 41.9 pt -89.25 6.84 3.89 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.235 0 CA-C-O 125.215 2.436 . . . . 18.17 111.724 174.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.62 48.45 10.44 Favored Glycine 0 N--CA 1.43 -1.756 2 C-N-CA 132.908 5.051 . . . . 17.83 110.736 171.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' CYS . . . . . 0.853 ' HB2' ' HB3' ' B' ' 99' ' ' PHE 0.355 0.0 OUTLIER -101.2 144.09 30.49 Favored 'General case' 0 N--CA 1.498 1.951 1 C-N-CA 110.776 -4.37 . . . . 22.93 108.915 -166.663 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.7 p -128.03 178.96 5.84 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 123.534 1.635 . . . . 17.07 110.864 -175.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 26' ' ' THR 0.308 14.7 tp -129.74 131.83 46.4 Favored 'General case' 0 C--N 1.295 -1.79 1 N-CA-C 100.144 -4.021 . . . . 20.82 100.144 -177.549 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.826 HD22 ' HG3' ' B' ' 2' ' ' GLN . 0.1 OUTLIER -139.85 141.46 36.65 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-O 126.295 2.95 . . . . 32.26 108.983 -174.91 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.454 ' OXT' ' HD2' ' B' ' 1' ' ' PRO . 32.2 p90 . . . . . 0 C--N 1.315 -0.896 0 N-CA-C 103.924 -2.621 . . . . 28.32 103.924 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PRO . . . . . 0.454 ' HD2' ' OXT' ' A' ' 99' ' ' PHE . 7.4 Cg_endo . . . . . 0 N--CA 1.425 -2.515 0 CA-C-O 128.514 3.464 . . . . 31.09 114.248 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.826 ' HG3' HD22 ' A' ' 98' ' ' ASN . 28.5 tt0 -117.75 121.93 42.13 Favored 'General case' 0 C--O 1.243 0.721 1 CA-C-N 107.303 -4.499 . . . . 35.37 104.698 170.867 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 1.3 mt -110.04 121.92 63.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 N-CA-C 106.724 -1.584 . . . . 22.39 106.724 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 73.9 p -93.87 157.94 15.89 Favored 'General case' 0 C--O 1.208 -1.096 0 N-CA-C 107.692 -1.225 . . . . 23.9 107.692 172.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 63.4 mt -103.77 15.73 28.07 Favored 'General case' 0 CA--C 1.493 -1.239 0 N-CA-C 119.46 3.133 . . . . 15.38 119.46 -167.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -61.01 -29.96 70.02 Favored 'General case' 0 C--O 1.245 0.85 0 CA-C-O 126.408 3.004 . . . . 17.66 114.536 166.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -122.73 156.74 33.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 117.382 -3.324 . . . . 29.84 104.636 174.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -49.21 128.99 16.51 Favored Pre-proline 0 C--N 1.326 -0.452 0 O-C-N 120.15 -1.594 . . . . 45.3 109.964 171.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -71.94 86.85 0.89 Allowed 'Trans proline' 0 N--CA 1.481 0.789 0 C-N-CA 123.067 2.511 . . . . 12.67 111.519 173.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . 0.26 12.1 mt -107.75 141.53 39.14 Favored 'General case' 0 N--CA 1.44 -0.956 1 O-C-N 115.904 -4.247 . . . . 17.9 108.911 -169.868 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' B' ' 67' ' ' CYS 0.398 0.4 OUTLIER -145.88 154.37 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.3 1 C-N-CA 110.469 -4.493 . . . . 12.45 105.93 -169.614 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -82.15 130.45 35.09 Favored 'General case' 0 C--N 1.304 -1.393 1 CA-C-O 129.411 4.434 . . . . 20.79 112.357 170.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' B' ' 65' ' ' GLU . 12.1 pt -123.24 153.79 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.187 0 CA-C-O 127.204 3.383 . . . . 14.13 107.661 172.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 37.6 tttt -123.42 122.57 38.6 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 101.717 -3.438 . . . . 28.79 101.717 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ILE . . . . . 0.477 ' O ' ' HB2' ' B' ' 18' ' ' GLN . 13.0 tt -151.4 124.57 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 O-C-N 128.373 3.546 . . . . 16.55 108.185 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.05 38.25 95.74 Favored Glycine 0 C--O 1.22 -0.724 0 CA-C-O 123.341 1.523 . . . . 16.67 115.46 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.26 -5.12 81.72 Favored Glycine 0 N--CA 1.451 -0.367 0 CA-C-N 114.013 -1.093 . . . . 20.42 110.958 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' B' ' 15' ' ' ILE . 73.8 mt-30 -110.65 140.87 44.6 Favored 'General case' 0 N--CA 1.416 -2.141 0 N-CA-C 119.494 3.146 . . . . 17.81 119.494 -172.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.92 131.52 37.18 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 126.865 2.603 . . . . 12.58 109.204 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.548 ' HE3' ' SD ' ' B' ' 36' ' ' MET . 43.4 mttm -144.59 168.4 20.24 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-O 118.833 -0.603 . . . . 19.85 111.375 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -114.29 134.39 54.98 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 116.074 -1.917 . . . . 24.91 106.198 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -134.92 149.77 50.32 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 119.918 1.235 . . . . 8.38 110.244 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . 0.272 0.3 OUTLIER -85.89 136.6 33.22 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.553 -0.748 . . . . 17.26 112.077 175.865 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.68 116.09 23.02 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 119.076 -2.265 . . . . 11.9 106.433 177.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.475 ' HB3' ' CG2' ' B' ' 84' ' ' ILE . 64.7 t0 -127.36 101.3 6.4 Favored 'General case' 0 CA--C 1.51 -0.595 0 C-N-CA 118.634 -1.227 . . . . 13.09 111.31 -167.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 74.8 p -70.55 -16.78 62.91 Favored 'General case' 0 CA--C 1.49 -1.362 0 C-N-CA 116.171 -2.212 . . . . 10.75 110.215 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -83.24 8.91 62.44 Favored Glycine 0 C--O 1.227 -0.316 2 CA-C-N 127.199 4.545 . . . . 12.23 111.785 178.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -116.84 119.03 34.12 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 116.955 -3.674 . . . . 10.37 107.429 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -60.26 -41.09 92.53 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 116.783 -3.698 . . . . 15.2 112.354 171.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.553 ' HB2' ' O4 ' ' A' ' 100' ' ' U0E 0.427 65.9 m-20 -112.51 164.61 13.09 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 134.057 4.943 . . . . 17.62 119.099 -176.748 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 26.3 m -104.57 120.2 40.74 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 107.786 -1.19 . . . . 12.47 107.786 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . 0.73 HG12 HD12 ' B' ' 84' ' ' ILE . 1.9 p -123.36 121.05 61.83 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 114.688 -1.142 . . . . 14.44 109.543 -175.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.653 HD23 HG13 ' B' ' 75' ' ' VAL . 2.9 mm? -120.54 144.45 48.06 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-O 127.714 3.626 . . . . 20.16 105.3 -175.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -44.09 149.81 0.32 Allowed 'General case' 0 C--N 1.304 -1.378 0 O-C-N 118.918 -2.364 . . . . 39.85 106.185 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' B' ' 109' ' ' HOH . 0.4 OUTLIER -52.96 116.26 2.27 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-O 126.702 3.144 . . . . 40.98 113.197 177.704 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' MET . . . . . 0.548 ' SD ' ' HE3' ' B' ' 20' ' ' LYS . 5.4 ptt? -147.47 172.74 13.48 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 118.921 -2.362 . . . . 31.8 111.161 -175.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 71.9 m -81.69 109.72 16.37 Favored 'General case' 0 C--O 1.252 1.231 1 O-C-N 130.226 4.704 . . . . 39.75 113.902 -176.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -134.4 125.52 17.78 Favored Pre-proline 0 N--CA 1.48 1.069 0 C-N-CA 115.912 -2.315 . . . . 35.78 106.59 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -67.23 149.63 81.54 Favored 'Trans proline' 0 N--CA 1.438 -1.774 0 O-C-N 125.895 2.524 . . . . 36.9 111.699 174.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' GLY . . . . . . . . . . . . . . . 116.84 -171.59 13.86 Favored Glycine 0 CA--C 1.522 0.527 0 CA-C-O 124.65 2.25 . . . . 38.86 113.675 175.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -106.93 156.0 19.18 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 106.348 -1.723 . . . . 55.9 106.348 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TRP . . . . . . . . . . . . 0.306 32.7 p-90 -147.8 169.04 20.63 Favored 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 124.769 1.228 . . . . 37.35 110.264 174.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -119.36 138.23 26.21 Favored Pre-proline 0 C--O 1.215 -0.722 0 O-C-N 126.41 2.319 . . . . 40.54 110.832 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -59.42 140.34 93.77 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 N-CA-C 105.131 -2.68 . . . . 31.13 105.131 174.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 27.7 tttt -150.13 169.06 22.17 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 101.569 -3.493 . . . . 31.04 101.569 177.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' MET . . . . . . . . . . . . 0.263 30.0 mtt -143.31 136.32 27.83 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 120.936 1.698 . . . . 37.24 109.835 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . 0.438 HG21 ' N3 ' ' A' ' 100' ' ' U0E . 17.4 pt -124.81 160.01 30.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.305 0 CA-C-O 126.582 3.087 . . . . 23.2 112.405 173.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -114.65 158.61 14.21 Favored Glycine 0 C--O 1.217 -0.948 1 CA-C-O 128.025 4.125 . . . . 18.85 116.3 174.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -154.89 -151.12 5.74 Favored Glycine 0 C--O 1.214 -1.131 0 N-CA-C 103.896 -3.682 . . . . 16.34 103.896 171.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . 0.985 HG22 ' HA3' ' A' ' 49' ' ' GLY 0.492 0.0 OUTLIER -76.06 138.01 21.6 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 0 O-C-N 120.516 -1.579 . . . . 23.65 106.966 179.993 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.32 -26.07 19.35 Favored Glycine 0 C--O 1.246 0.875 2 O-C-N 114.804 -4.935 . . . . 25.69 109.742 -176.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 137.84 -152.0 21.54 Favored Glycine 0 C--N 1.337 0.596 1 CA-C-N 125.181 4.49 . . . . 23.32 118.577 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . 0.28 0.0 OUTLIER -110.99 140.61 45.37 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 112.706 -3.521 . . . . 32.55 114.635 -173.582 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . 0.442 HG13 HG13 ' B' ' 56' ' ' VAL . 29.2 pt -123.5 158.61 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 114.253 -2.979 . . . . 21.95 108.007 169.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -96.12 126.96 41.71 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 104.993 -2.225 . . . . 36.25 104.993 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' VAL . . . . . 0.442 HG13 HG13 ' B' ' 54' ' ' ILE . 28.7 m -131.5 162.95 38.47 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.154 0 O-C-N 118.308 -2.745 . . . . 18.54 105.137 -178.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.467 ' NH1' ' OE2' ' B' ' 35' ' ' GLU . 4.2 mtm180 -105.37 133.84 49.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 121.333 1.879 . . . . 24.89 106.677 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.428 ' NE2' ' O ' ' B' ' 126' ' ' HOH . 8.2 tt0 -98.41 117.24 32.38 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 117.209 2.3 . . . . 23.04 117.209 -176.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -109.77 120.48 42.6 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 117.962 -2.961 . . . . 26.45 108.872 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -93.64 153.75 18.21 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 124.418 2.056 . . . . 29.99 109.391 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 49.67 43.4 24.32 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 118.926 2.936 . . . . 31.29 118.926 -179.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ILE . . . . . . . . . . . . . 39.3 mm -87.12 135.93 24.14 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 1 O-C-N 113.804 -5.56 . . . . 23.06 113.198 175.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 46.0 tp -80.17 132.05 35.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 123.255 2.752 . . . . 14.19 110.057 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.519 HD11 ' CG2' ' B' ' 75' ' ' VAL . 1.0 OUTLIER -130.87 140.73 47.97 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 C-N-CA 128.325 2.65 . . . . 21.89 108.372 178.87 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' B' ' 70' ' ' LYS . 22.5 mt-10 -111.88 121.72 45.81 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 125.616 3.826 . . . . 31.62 105.255 167.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ILE . . . . . 0.551 ' HA ' HG22 ' B' ' 13' ' ' ILE . 64.4 mt -108.98 116.68 52.62 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 115.06 -2.4 . . . . 23.69 107.71 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' B' ' 11' ' ' VAL . 0.5 OUTLIER 42.46 55.63 4.04 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 126.678 3.132 . . . . 41.6 109.203 -174.161 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 43.68 50.54 7.05 Favored Glycine 0 N--CA 1.43 -1.744 1 CA-C-O 113.046 -4.197 . . . . 36.57 113.623 -175.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HIS . . . . . 0.473 ' O ' ' HA ' ' B' ' 65' ' ' GLU 0.349 21.5 m80 -129.53 142.81 50.68 Favored 'General case' 0 N--CA 1.432 -1.344 2 CA-C-N 128.181 5.99 . . . . 32.49 103.919 170.428 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.64 ' HG2' ' HG2' ' B' ' 65' ' ' GLU . 0.7 OUTLIER -104.12 140.71 37.41 Favored 'General case' 0 C--O 1.253 1.265 0 CA-C-N 120.962 1.71 . . . . 33.53 113.98 -177.432 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ALA . . . . . . . . . . . . . . . -143.8 159.06 43.18 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 115.595 -2.145 . . . . 17.68 105.934 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.585 ' H ' HE22 ' B' ' 92' ' ' GLN . 31.0 mt -129.41 135.01 62.65 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 CA-C-N 124.669 3.395 . . . . 20.34 103.812 179.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . . . . . . . . . . . -173.71 -177.19 42.74 Favored Glycine 0 C--O 1.21 -1.402 0 O-C-N 125.519 1.762 . . . . 12.86 111.36 -175.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . 0.257 9.7 m -82.33 140.42 33.56 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 103.57 -2.752 . . . . 21.24 103.57 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' VAL . . . . . 0.653 HG13 HD23 ' B' ' 33' ' ' LEU . 18.6 t -133.19 121.17 42.36 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.406 0 O-C-N 127.786 3.179 . . . . 17.37 104.976 -176.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 70.2 mt -96.55 138.21 34.47 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-O 113.318 -3.229 . . . . 15.66 107.635 177.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 97.2 t -124.53 112.7 33.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.638 0 CA-C-N 123.419 2.827 . . . . 20.3 109.992 -174.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.14 -165.16 26.06 Favored Glycine 0 N--CA 1.448 -0.519 0 O-C-N 117.577 -3.202 . . . . 17.67 111.113 -175.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.05 38.25 0.07 OUTLIER 'Trans proline' 0 C--O 1.246 0.922 0 N-CA-C 121.662 3.678 . . . . 17.61 121.662 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' THR . . . . . 0.711 ' OG1' HD11 ' A' ' 50' ' ' ILE . 9.7 t -81.15 144.77 54.97 Favored Pre-proline 0 C--N 1.314 -0.941 0 O-C-N 118.258 -2.776 . . . . 16.15 112.365 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.967 ' HG2' ' H91' ' A' ' 100' ' ' U0E . 9.6 Cg_endo -62.97 -40.37 34.96 Favored 'Trans proline' 0 C--O 1.255 1.332 0 C-N-CA 122.719 2.279 . . . . 20.88 117.143 176.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASN . . . . . 0.711 ' OD1' ' H71' ' A' ' 100' ' ' U0E . 33.6 m120 -126.27 171.49 10.89 Favored 'General case' 0 C--O 1.203 -1.375 0 O-C-N 116.69 -3.756 . . . . 34.98 107.902 179.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -89.06 131.31 35.28 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 115.358 -2.258 . . . . 14.87 106.028 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . 0.73 HD12 HG12 ' B' ' 32' ' ' VAL 0.27 21.2 mt -120.34 132.8 68.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.777 0 CA-C-N 121.883 2.129 . . . . 13.08 109.918 -176.74 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ILE . . . . . . . . . . . . . 8.0 mm -99.78 124.29 53.08 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 N-CA-C 102.707 -3.072 . . . . 11.68 102.707 170.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' B' ' 90' ' ' LEU . . . -111.47 -170.87 18.99 Favored Glycine 0 CA--C 1.493 -1.299 0 CA-C-O 115.643 -2.754 . . . . 8.75 108.719 -169.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -64.26 -26.72 68.62 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 118.949 1.374 . . . . 13.91 113.951 -178.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -57.3 -39.35 75.57 Favored 'General case' 0 C--O 1.211 -0.941 0 O-C-N 116.778 -3.701 . . . . 14.14 111.572 175.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.14 -35.3 13.25 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 116.616 -3.802 . . . . 14.27 112.285 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 86' ' ' GLY . 63.5 mt -58.56 -33.82 70.35 Favored 'General case' 0 C--N 1.324 -0.52 1 O-C-N 116.274 -4.016 . . . . 12.46 113.046 176.919 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 43.9 p -72.84 -24.5 60.9 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 119.266 -2.146 . . . . 18.09 107.518 173.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLN . . . . . 0.585 HE22 ' H ' ' B' ' 72' ' ' ILE . 4.0 mt-30 -72.27 -39.78 68.12 Favored 'General case' 0 CA--C 1.497 -1.074 0 O-C-N 119.677 -1.889 . . . . 29.34 115.512 178.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 43.3 pt -87.01 11.1 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 119.26 -2.15 . . . . 18.21 113.43 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 73.28 28.93 65.1 Favored Glycine 0 N--CA 1.43 -1.743 0 CA-C-O 117.574 -1.681 . . . . 16.83 116.346 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 41.4 t -81.07 130.8 35.18 Favored 'General case' 0 C--O 1.255 1.383 0 CA-C-N 121.168 2.484 . . . . 21.06 113.585 -175.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' THR . . . . . . . . . . . . . 74.5 p -123.34 164.79 18.13 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-O 128.102 3.811 . . . . 16.89 112.783 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.0 tp -111.22 126.79 55.25 Favored 'General case' 0 C--O 1.196 -1.738 0 N-CA-C 104.465 -2.421 . . . . 20.19 104.465 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.401 ' ND2' ' OD1' ' A' ' 98' ' ' ASN 0.38 15.0 m-80 -119.88 127.5 52.78 Favored 'General case' 0 N--CA 1.401 -2.88 0 C-N-CA 130.638 3.575 . . . . 35.48 117.955 175.774 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' PHE . . . . . 0.853 ' HB3' ' HB2' ' A' ' 95' ' ' CYS . 38.5 p90 . . . . . 0 CA--C 1.503 -0.843 1 O-C-N 129.319 4.137 . . . . 25.67 109.137 171.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' U0E . . . . . 0.967 ' H91' ' HG2' ' B' ' 81' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' U0E . . . . . 0.958 ' H91' ' CG ' ' A' ' 81' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . 0.412 ' O ' ' HB2' ' A' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . 0.515 ' O ' ' HE3' ' A' ' 46' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . 0.513 ' O ' ' HG2' ' B' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . 0.454 ' O ' ' HB2' ' B' ' 35' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . 0.428 ' O ' ' NE2' ' B' ' 58' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' HOH . . . . . 0.459 ' O ' ' HG2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_