data_1hho_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 1hho _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' ' ' VAL . . . . . . . . . . . . 0.313 3.0 p . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 118.029 -0.986 . . . . 81.71 109.063 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 61.5 mt 76.25 113.97 0.07 Allowed 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 124.009 1.861 . . . . 67.33 111.221 -168.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . 0.649 ' OG ' ' O ' ' A' ' 190' ' ' HOH . 96.4 p -98.21 167.92 10.78 Favored Pre-proline 0 C--N 1.292 -1.926 0 CA-C-N 111.673 -2.512 . . . . 79.52 105.919 -167.78 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -46.83 -25.09 3.48 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 125.737 2.441 . . . . 53.74 110.806 172.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.62 -23.54 15.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 116.78 -1.968 . . . . 54.02 110.325 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -69.0 -50.02 52.62 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 105.281 -2.118 . . . . 29.92 105.281 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.292 0.0 OUTLIER -58.56 -29.96 66.79 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 126.128 2.142 . . . . 95.17 109.728 178.404 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.3 m -71.74 -43.27 66.12 Favored 'General case' 0 C--N 1.288 -2.099 1 O-C-N 115.557 -4.464 . . . . 43.27 114.863 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . 0.262 5.4 m120 -67.18 -37.03 83.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 130.407 3.483 . . . . 82.68 111.438 176.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.04 -31.78 16.91 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 C-N-CA 114.37 -2.932 . . . . 45.09 106.966 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -62.54 -20.84 65.05 Favored 'General case' 0 C--N 1.388 2.25 0 O-C-N 127.638 3.086 . . . . 100.0 105.047 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -111.99 -37.31 5.13 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 117.477 2.399 . . . . 61.43 117.477 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.8 -23.88 67.53 Favored 'General case' 0 C--N 1.247 -3.861 0 C-N-CA 112.165 -3.814 . . . . 33.27 110.199 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 -77.77 -39.69 43.24 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 115.784 -2.366 . . . . 100.0 108.492 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -42.38 -59.5 3.05 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 128.122 3.389 . . . . 72.64 110.541 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -62.39 -24.81 67.59 Favored 'General case' 0 C--N 1.276 -2.593 0 C-N-CA 128.948 2.899 . . . . 92.73 116.116 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.7 t -76.73 -26.12 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-N 121.342 1.883 . . . . 42.38 113.214 172.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 30.34 -123.93 0.14 Allowed Glycine 0 CA--C 1.535 1.283 0 CA-C-O 124.194 1.997 . . . . 49.29 117.756 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -19.75 65.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 109.116 -3.542 . . . . 58.31 111.171 -169.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -85.92 9.11 17.81 Favored 'General case' 0 C--N 1.293 -1.848 0 C-N-CA 114.326 -2.95 . . . . 86.48 112.021 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.49 85.43 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 115.615 -2.434 . . . . 88.84 111.762 -168.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.74 -36.63 91.51 Favored Glycine 0 N--CA 1.483 1.796 0 O-C-N 125.438 1.711 . . . . 53.43 112.937 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' ' 158' ' ' HOH . 5.4 mt-10 -65.64 -23.77 66.88 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 124.714 2.197 . . . . 100.0 110.804 173.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . 0.695 ' CB ' ' O ' ' A' ' 160' ' ' HOH . 15.8 m-30 -89.96 -27.39 19.84 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 118.685 -2.509 . . . . 65.27 105.25 -173.483 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.3 -15.21 81.75 Favored Glycine 0 N--CA 1.403 -3.52 0 C-N-CA 114.951 -3.499 . . . . 42.9 107.67 -172.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.35 -26.2 18.19 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 103.151 -2.907 . . . . 25.61 103.151 -173.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -75.8 -29.66 58.8 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.401 3.563 . . . . 58.45 108.983 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.354 . . -73.44 -36.29 65.89 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.785 1.755 . . . . 24.49 106.614 -169.305 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.77 -48.84 75.33 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-N 109.257 -3.61 . . . . 29.21 109.568 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . 0.919 ' OE1' ' O ' ' A' ' 163' ' ' HOH . 35.5 tt0 -57.1 -49.58 75.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 126.114 2.134 . . . . 75.17 112.885 175.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -48.4 -39.22 21.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.963 -1.017 . . . . 53.44 112.924 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.0 ttp -77.8 -40.79 39.47 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 125.075 1.485 . . . . 22.55 109.504 -168.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -62.8 -33.75 75.84 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.801 -2.0 . . . . 59.79 106.905 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.79 -41.84 25.69 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.947 2.654 . . . . 72.74 111.222 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 25.6 m -90.77 -34.54 15.3 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 126.441 3.02 . . . . 31.92 111.489 -166.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -123.77 84.96 53.73 Favored Pre-proline 0 C--N 1.287 -2.129 0 CA-C-N 110.647 -2.979 . . . . 44.11 110.057 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . 1.114 ' CB ' ' O ' ' A' ' 155' ' ' HOH . 48.1 Cg_exo -69.95 -9.46 26.09 Favored 'Trans proline' 0 C--N 1.293 -2.389 0 C-N-CA 121.983 1.788 . . . . 43.44 111.161 -167.663 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -26.09 60.3 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 123.716 1.722 . . . . 46.82 110.246 -176.04 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.4 p -66.04 -28.8 69.13 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 112.968 -1.924 . . . . 34.16 110.05 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm -50.31 -18.5 0.62 Allowed 'General case' 0 N--CA 1.481 1.118 0 O-C-N 125.867 1.979 . . . . 59.59 114.182 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.73 -19.98 65.87 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.962 1.305 . . . . 45.66 113.848 -174.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -89.03 -13.74 38.07 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 118.143 -1.423 . . . . 65.17 109.684 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -121.25 50.09 1.99 Allowed Pre-proline 0 N--CA 1.431 -1.379 0 CA-C-N 111.5 -2.591 . . . . 54.38 111.126 -165.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -80.93 -2.34 11.74 Favored 'Trans proline' 0 C--N 1.318 -1.057 0 C-N-CA 117.145 -1.437 . . . . 70.51 109.503 -166.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -110.7 14.04 22.35 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 127.231 3.396 . . . . 70.4 107.532 -174.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -111.97 143.63 42.64 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 110.785 -2.916 . . . . 62.12 108.538 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -79.0 119.19 21.79 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 111.453 -2.612 . . . . 57.27 104.612 159.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.19 24.66 10.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.796 1.284 . . . . 61.6 107.649 -172.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -95.49 163.93 13.02 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-N 113.424 -1.716 . . . . 45.92 107.438 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -43.64 -64.65 0.61 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 126.688 2.492 . . . . 86.32 111.968 -163.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.8 19.2 38.83 Favored Glycine 0 N--CA 1.48 1.583 0 C-N-CA 115.335 -3.317 . . . . 51.97 111.428 -166.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.6 t -64.26 120.72 12.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 123.361 1.553 . . . . 62.46 113.327 -174.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.63 -36.98 62.62 Favored 'General case' 0 C--N 1.301 -1.53 2 CA-C-N 106.732 -4.758 . . . . 57.08 109.642 175.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -73.33 -47.24 44.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 106.789 -1.56 . . . . 59.71 106.789 -172.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.16 -32.94 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 126.071 2.107 . . . . 27.99 112.561 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -45.8 91.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 125.077 2.37 . . . . 78.48 109.158 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.51 -13.53 82.47 Favored Glycine 0 C--N 1.272 -3.009 0 CA-C-N 111.42 -2.627 . . . . 38.42 109.82 -169.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -81.59 -47.82 12.57 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 127.292 2.407 . . . . 62.16 112.21 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -35.15 -46.21 0.67 Allowed Glycine 0 N--CA 1.439 -1.139 0 C-N-CA 128.513 2.959 . . . . 33.91 107.2 162.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -65.49 -40.17 92.75 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 126.09 1.7 . . . . 58.48 106.634 -170.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -71.45 -47.86 53.04 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 128.008 3.317 . . . . 89.62 111.294 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.72 -48.56 83.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 126.649 2.468 . . . . 28.91 107.367 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.14 91.95 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.706 1.254 . . . . 44.39 113.579 -174.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . 0.864 ' OD1' ' O ' ' A' ' 180' ' ' HOH . 98.6 m-20 -63.18 -37.79 88.61 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 127.063 2.727 . . . . 60.55 110.504 174.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.71 -24.6 58.78 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 116.248 -2.181 . . . . 37.14 108.875 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.6 mt -71.32 -37.04 71.77 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 116.809 -1.956 . . . . 41.12 110.227 177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 48.0 m -74.2 -31.5 62.67 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 124.995 1.434 . . . . 59.86 109.874 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -71.39 -36.94 71.57 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 104.171 -2.529 . . . . 97.63 104.171 177.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.46 -43.9 97.69 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 120.114 1.325 . . . . 30.09 113.806 172.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.67 -43.06 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.83 0 CA-C-O 124.383 2.04 . . . . 34.57 111.129 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . 0.318 . . -97.6 89.02 4.51 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 113.315 -3.231 . . . . 48.14 104.946 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.3 m80 119.82 17.08 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.101 0 C-N-CA 130.972 3.709 . . . . 84.66 107.537 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 9.1 p -47.48 -30.88 2.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 116.723 -1.608 . . . . 35.31 112.763 173.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -93.03 11.35 27.84 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 106.515 -1.661 . . . . 81.08 106.515 -173.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -165.28 45.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 128.765 3.791 . . . . 90.25 115.703 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.3 mtt -58.95 -46.31 99.54 Favored Pre-proline 0 C--N 1.301 -1.506 0 CA-C-N 113.038 -1.892 . . . . 66.35 111.42 171.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -43.6 -57.34 1.88 Allowed 'Trans proline' 0 CA--C 1.555 1.545 0 CA-C-N 120.585 1.245 . . . . 47.93 112.201 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -68.92 -26.6 65.17 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 121.926 2.148 . . . . 89.0 110.717 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -81.24 -33.26 32.93 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 117.329 -1.748 . . . . 69.86 111.478 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.0 mt -102.67 12.23 36.61 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 104.162 -2.532 . . . . 49.53 104.162 -172.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 p -35.53 -62.96 0.38 Allowed 'General case' 0 C--N 1.321 -0.671 0 O-C-N 128.324 3.515 . . . . 85.67 112.165 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.36 -33.68 61.08 Favored 'General case' 0 C--O 1.208 -1.089 0 C-N-CA 117.85 -1.54 . . . . 66.87 114.797 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 69.7 mt -61.17 -27.96 68.78 Favored 'General case' 0 C--N 1.279 -2.467 0 O-C-N 117.136 -3.478 . . . . 65.51 114.445 170.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 13.9 m -61.28 -48.39 81.63 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 123.878 1.799 . . . . 51.44 108.286 174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -62.79 -51.12 68.33 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 116.353 -1.784 . . . . 94.06 111.401 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -43.93 95.2 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 127.236 2.835 . . . . 74.53 110.812 -179.088 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -80.35 -38.09 31.18 Favored 'General case' 0 C--N 1.297 -1.708 0 C-N-CA 112.715 -3.594 . . . . 35.39 113.143 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -92.03 -35.29 14.03 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 124.245 0.966 . . . . 56.83 110.85 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HIS . . . . . 0.42 ' CE1' ' NZ ' ' A' ' 139' ' ' LYS . 3.9 m80 -77.54 -65.56 0.95 Allowed 'General case' 0 CA--C 1.478 -1.802 0 C-N-CA 117.375 -1.73 . . . . 100.0 112.755 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -77.74 -42.35 34.55 Favored 'General case' 0 C--N 1.303 -1.416 2 O-C-N 132.849 6.343 . . . . 96.11 108.989 -167.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 90.2 mt -97.25 -21.04 17.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 114.815 -2.754 . . . . 61.81 113.784 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.47 54.57 8.33 Favored 'General case' 0 C--O 1.252 1.202 0 CA-C-O 118.034 -0.984 . . . . 77.26 110.598 -179.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.7 t -75.99 135.01 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 126.247 2.217 . . . . 53.73 112.175 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -71.89 127.98 90.0 Favored Pre-proline 0 C--N 1.303 -1.448 0 N-CA-C 103.986 -2.598 . . . . 24.87 103.986 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -62.65 -21.92 73.42 Favored 'Trans proline' 0 C--N 1.284 -2.851 0 C-N-CA 123.102 2.534 . . . . 39.65 107.762 -170.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -24.63 32.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.992 0 O-C-N 126.989 2.681 . . . . 60.77 107.091 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -67.35 -21.9 65.61 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 117.016 -1.873 . . . . 25.11 114.649 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -72.3 -31.3 65.58 Favored 'General case' 0 C--N 1.274 -2.711 0 CA-C-O 117.539 -1.22 . . . . 34.9 111.436 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -72.32 -38.58 68.64 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 127.061 2.726 . . . . 74.9 111.588 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 49.1 mt -69.77 -36.39 75.72 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 119.552 1.069 . . . . 46.39 113.66 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.1 tp -69.69 -40.95 76.05 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 124.567 1.167 . . . . 39.55 108.764 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.0 m -63.61 -33.7 76.19 Favored 'General case' 0 CA--C 1.491 -1.32 0 O-C-N 126.712 2.508 . . . . 30.24 109.809 -171.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . 0.628 ' CD2' ' O ' ' A' ' 154' ' ' HOH . 28.2 t-80 -72.24 -41.48 66.74 Favored 'General case' 0 C--N 1.273 -2.757 0 O-C-N 127.46 2.975 . . . . 54.49 108.999 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 90.6 m -69.34 -36.61 77.09 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 114.194 -3.003 . . . . 31.59 113.898 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -46.71 -48.33 20.3 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 123.895 0.878 . . . . 23.77 113.163 162.814 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.49 -48.02 51.74 Favored 'General case' 0 C--N 1.359 0.991 0 O-C-N 119.186 -2.196 . . . . 33.14 112.29 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 70.7 t -45.36 -40.15 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 126.377 1.871 . . . . 60.61 109.659 167.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . 0.745 ' CG2' ' O ' ' A' ' 160' ' ' HOH . 17.7 m -77.37 -35.15 54.78 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 119.528 -1.983 . . . . 30.91 111.24 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . 0.857 ' CD1' ' O ' ' A' ' 161' ' ' HOH . 0.0 OUTLIER -65.66 -50.84 63.48 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.826 1.648 . . . . 41.2 107.947 177.592 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -52.19 -39.66 60.45 Favored 'General case' 0 N--CA 1.48 1.026 1 O-C-N 129.637 4.336 . . . . 34.99 112.56 177.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.93 -8.71 59.69 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 127.159 2.787 . . . . 42.48 104.715 -166.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 -116.61 -27.08 6.81 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 127.053 2.721 . . . . 56.16 112.687 -169.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . 0.254 50.2 mt -137.06 66.07 53.08 Favored Pre-proline 0 N--CA 1.49 1.543 0 CA-C-O 114.329 -2.748 . . . . 55.5 112.464 -165.895 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -81.44 -13.59 10.88 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.682 2.921 . . . . 69.77 112.964 -160.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.51 -46.05 60.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.329 1.643 . . . . 39.4 108.636 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -81.74 -32.3 31.6 Favored 'General case' 0 N--CA 1.49 1.525 2 O-C-N 129.6 4.312 . . . . 97.56 113.254 -169.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -82.51 55.07 2.81 Favored 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 126.656 2.473 . . . . 43.19 108.954 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 38.3 p -63.66 152.73 85.5 Favored Pre-proline 0 N--CA 1.485 1.319 0 O-C-N 127.504 3.002 . . . . 89.76 110.581 171.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -42.37 -34.04 2.89 Favored 'Trans proline' 0 C--O 1.24 0.615 1 C-N-CA 126.062 4.508 . . . . 39.85 111.25 169.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -87.79 -22.59 24.44 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 125.749 1.906 . . . . 46.05 110.28 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 31.7 t -87.5 -28.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 C-N-CA 115.526 -2.47 . . . . 32.54 107.622 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -59.46 -45.58 91.22 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 128.04 3.338 . . . . 21.33 106.763 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.31 97.3 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 115.747 -2.073 . . . . 55.18 113.637 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.3 m -68.18 -34.16 75.79 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 127.18 2.8 . . . . 47.74 107.13 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.49 -50.21 12.04 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 111.026 -2.806 . . . . 44.9 107.753 -173.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -43.54 -52.6 6.12 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 117.435 -1.706 . . . . 43.3 115.429 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -63.63 -47.08 82.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 128.819 3.824 . . . . 69.68 107.413 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -57.49 -40.99 79.84 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 114.969 -2.692 . . . . 34.69 112.371 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.36 -22.99 58.95 Favored 'General case' 0 C--N 1.288 -2.085 0 C-N-CA 114.578 -2.849 . . . . 33.08 107.955 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.99 64.99 Favored 'General case' 0 C--N 1.287 -2.141 0 O-C-N 127.018 2.699 . . . . 41.01 110.968 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.4 m -83.08 -37.71 23.48 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 118.01 -1.476 . . . . 48.37 108.554 -171.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 66.6 t -58.48 -43.77 87.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 109.554 -3.475 . . . . 38.22 112.664 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.2 m -67.22 -38.84 85.93 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 126.111 2.132 . . . . 35.44 109.295 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.0 m -65.42 -41.32 93.68 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 126.276 2.235 . . . . 52.65 112.474 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.99 -50.33 78.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 126.153 2.158 . . . . 31.43 111.611 169.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 89.5 mt -78.66 1.57 22.39 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-N 120.013 1.279 . . . . 54.17 112.037 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 19.0 p -120.37 11.83 11.55 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.13 -1.606 . . . . 44.96 112.532 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 97.5 p -89.21 -5.0 58.02 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 125.119 1.367 . . . . 74.4 109.384 -167.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LYS . . . . . 0.42 ' NZ ' ' CE1' ' A' ' 89' ' ' HIS 0.306 9.7 tttt -92.34 -1.93 56.72 Favored 'General case' 0 C--O 1.244 0.774 1 C-N-CA 108.477 -5.289 . . . . 100.0 109.747 166.347 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.7 -16.85 59.4 Favored 'General case' 0 N--CA 1.532 3.649 0 C-N-CA 116.63 -2.028 . . . . 100.0 115.166 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 82.7 mtt-85 . . . . . 0 C--N 1.318 -0.782 0 C-N-CA 128.802 2.841 . . . . 100.0 109.146 -172.537 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.24 0.578 0 CA-C-O 124.48 2.086 . . . . 79.18 114.396 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' HIS . . . . . . . . . . . . 0.338 10.3 t-160 -127.65 -71.2 0.67 Allowed 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 110.012 -3.267 . . . . 100.0 104.376 168.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.33 115.8 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.838 2 O-C-N 130.926 5.141 . . . . 62.35 107.308 -177.154 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 1.4 p -83.97 165.6 38.32 Favored Pre-proline 0 C--N 1.3 -1.574 1 C-N-CA 110.908 -4.317 . . . . 82.25 101.105 -174.039 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -42.09 -48.79 6.19 Favored 'Trans proline' 0 C--N 1.294 -2.336 0 C-N-CA 124.636 3.557 . . . . 62.28 112.893 178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -70.64 -41.89 71.58 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 126.116 2.135 . . . . 85.37 110.295 -174.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.23 -45.64 92.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 127.196 2.81 . . . . 62.36 109.878 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -53.56 -44.66 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 125.615 1.822 . . . . 81.55 107.379 175.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -33.76 76.26 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 106.097 -1.816 . . . . 60.26 106.097 -168.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -35.65 20.76 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 127.363 2.914 . . . . 78.87 113.731 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.94 -41.82 85.05 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.182 0 N-CA-C 115.198 1.555 . . . . 55.13 115.198 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . 0.5 1.1 m -73.45 -47.91 37.8 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 130.787 3.635 . . . . 60.42 110.788 -175.024 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.12 68.05 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.155 -1.839 . . . . 56.83 115.708 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.4 mt -83.62 -38.38 21.65 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 119.987 1.267 . . . . 76.2 111.181 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -66.57 -31.66 72.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.597 3.686 . . . . 66.36 113.264 -170.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.1 -46.8 92.23 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 129.006 3.941 . . . . 69.17 111.377 169.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 29.9 mttt -64.48 -31.32 72.49 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.621 1.712 . . . . 75.54 115.621 174.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 4.5 t -62.94 122.76 14.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 N-CA-C 114.263 1.209 . . . . 42.76 114.263 -169.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -66.76 96.82 0.42 Allowed 'General case' 0 N--CA 1.49 1.544 1 O-C-N 129.707 4.38 . . . . 62.48 107.296 172.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -15.8 15.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 123.857 0.723 . . . . 95.58 112.39 -176.667 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.29 -32.6 55.54 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 114.156 -3.018 . . . . 85.46 108.701 173.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' B' ' 172' ' ' HOH . 1.6 mm-40 -112.9 -0.18 14.94 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 114.928 -2.709 . . . . 100.0 110.647 -169.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 26.6 t -92.15 -35.45 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 119.154 -2.216 . . . . 55.97 109.179 -175.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -61.37 -32.65 81.72 Favored Glycine 0 N--CA 1.485 1.937 0 O-C-N 125.922 2.013 . . . . 40.4 112.313 -176.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -85.25 -29.41 27.94 Favored Glycine 0 N--CA 1.442 -0.965 0 O-C-N 126.542 1.966 . . . . 42.32 110.731 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.63 68.16 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 106.732 -1.581 . . . . 56.98 106.732 174.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.59 -37.1 28.17 Favored 'General case' 0 C--N 1.283 -2.313 0 C-N-CA 113.385 -3.326 . . . . 46.95 116.938 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.18 -32.86 74.35 Favored 'General case' 0 N--CA 1.506 2.372 0 CA-C-N 119.871 1.214 . . . . 59.01 111.109 171.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.45 -44.45 41.61 Favored Glycine 0 C--N 1.291 -1.941 0 C-N-CA 117.802 -2.142 . . . . 45.26 108.903 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.7 mtt-85 -61.99 -30.96 71.29 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.578 -0.811 . . . . 48.92 109.876 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.27 -35.31 79.24 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 126.385 2.303 . . . . 48.35 109.47 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 mt -82.73 -20.55 35.79 Favored 'General case' 0 CA--C 1.491 -1.294 0 C-N-CA 113.659 -3.216 . . . . 50.39 103.866 -166.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.94 -37.04 9.15 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 105.444 -2.058 . . . . 56.84 105.444 -173.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 38.9 t -82.54 -35.04 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 114.534 -2.867 . . . . 39.63 108.35 -168.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -122.5 85.89 48.49 Favored Pre-proline 0 C--O 1.243 0.726 0 CA-C-N 112.8 -2.0 . . . . 49.6 108.119 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.78 -25.98 39.08 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 123.892 3.062 . . . . 67.35 110.749 -164.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 42.8 p90 -59.0 -32.61 69.85 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 114.874 -2.73 . . . . 48.33 108.438 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 55.6 p -65.03 -19.36 65.96 Favored 'General case' 0 C--N 1.309 -1.195 0 O-C-N 126.883 2.615 . . . . 52.49 110.739 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -68.22 -14.2 62.81 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 114.637 -2.601 . . . . 75.69 110.85 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -34.96 -34.75 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 120.734 1.606 . . . . 93.31 110.178 162.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -94.46 -7.04 42.56 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.984 -1.008 . . . . 66.29 112.649 -161.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -133.84 39.49 3.15 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 125.441 1.713 . . . . 51.19 111.8 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . 0.681 ' CD ' ' O ' ' B' ' 174' ' ' HOH . 46.6 mt-10 -65.5 -27.55 68.56 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.108 -0.951 . . . . 98.3 109.177 173.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 11.8 p -70.11 -8.44 49.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.87 2.068 . . . . 94.12 111.127 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . 0.257 2.2 m-30 -101.5 -8.63 21.77 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 117.127 -1.416 . . . . 57.58 114.334 -167.165 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.18 -165.8 12.07 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 114.249 -3.834 . . . . 54.2 112.855 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.54 121.52 16.55 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 116.859 -1.936 . . . . 81.65 107.31 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 14.9 mt -124.79 37.56 4.38 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 126.272 2.232 . . . . 58.18 109.082 166.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.9 t -95.84 -8.45 34.13 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 112.753 -3.579 . . . . 97.75 105.82 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.81 146.17 54.01 Favored Pre-proline 0 C--N 1.264 -3.123 0 N-CA-C 103.82 -2.659 . . . . 80.68 103.82 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -69.06 -16.42 40.5 Favored 'Trans proline' 0 C--N 1.285 -2.768 0 C-N-CA 121.551 1.5 . . . . 48.43 110.749 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -74.85 -40.79 60.81 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.087 2.117 . . . . 82.96 107.448 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.48 -16.59 63.81 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 111.084 -2.78 . . . . 100.0 112.322 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 89.9 t -88.27 -31.12 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 117.707 -1.597 . . . . 85.34 108.109 177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' MET . . . . . . . . . . . . . 23.7 mmt -93.4 -8.78 40.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 114.072 -3.051 . . . . 83.59 113.299 -166.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -119.58 34.46 4.23 Favored Glycine 0 N--CA 1.482 1.706 0 O-C-N 127.348 2.905 . . . . 75.66 110.974 170.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -100.66 129.37 27.77 Favored Pre-proline 0 N--CA 1.434 -1.267 0 N-CA-C 105.975 -1.861 . . . . 74.21 105.975 174.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -81.46 -24.56 4.3 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 C-N-CA 123.917 3.078 . . . . 100.0 108.68 -164.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 9.0 mttp -74.82 -33.87 62.27 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 125.716 1.885 . . . . 82.78 106.863 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.91 -43.66 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 127.263 2.852 . . . . 66.97 110.413 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 15.4 pttt -76.34 -22.48 54.84 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.202 0.939 . . . . 100.0 110.683 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.94 -32.53 67.41 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 122.757 1.265 . . . . 68.71 109.224 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -90.56 -34.4 15.52 Favored 'General case' 0 N--CA 1.412 -2.325 0 CA-C-N 110.682 -2.963 . . . . 54.89 109.478 -170.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -66.45 -19.17 68.5 Favored Glycine 0 N--CA 1.501 2.99 0 CA-C-N 110.726 -2.943 . . . . 35.71 114.011 -174.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.5 tttm -83.17 -29.57 28.49 Favored 'General case' 0 C--O 1.25 1.106 0 C-N-CA 116.795 -1.962 . . . . 100.0 109.798 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -43.73 95.3 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 104.375 -2.454 . . . . 100.0 104.375 174.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.6 t -71.41 -25.67 25.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 O-C-N 126.099 2.124 . . . . 38.8 110.472 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . 0.428 ' CD1' ' O ' ' B' ' 196' ' ' HOH 0.271 17.3 mt -82.24 -21.74 36.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 111.921 -3.912 . . . . 66.31 107.444 -178.708 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -48.71 -65.98 2.36 Favored Glycine 0 C--O 1.245 0.835 1 O-C-N 131.006 5.191 . . . . 46.97 106.079 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -26.97 39.87 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.066 2.274 . . . . 74.61 110.993 -176.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -76.65 -36.89 57.1 Favored 'General case' 0 C--N 1.344 0.344 0 O-C-N 124.798 1.311 . . . . 62.77 109.397 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -67.98 -41.17 82.73 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 127.109 2.756 . . . . 71.14 104.839 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.46 -47.79 82.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 112.736 -2.029 . . . . 92.64 111.276 170.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.77 -40.06 32.33 Favored Glycine 0 C--N 1.314 -0.69 1 C-N-CA 113.149 -4.358 . . . . 53.13 112.196 -174.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 17.4 tp -55.7 -24.45 34.54 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 127.177 2.34 . . . . 84.31 111.83 -169.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -137.35 57.17 1.75 Allowed 'General case' 0 C--N 1.316 -0.889 0 O-C-N 126.043 2.089 . . . . 98.3 110.329 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -171.08 34.63 0.02 OUTLIER 'General case' 0 C--O 1.246 0.875 2 C-N-CA 133.178 4.591 . . . . 95.95 109.063 178.871 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 34.9 mt -71.71 -2.26 16.77 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 117.905 -1.518 . . . . 73.85 110.793 -168.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -86.62 -32.65 20.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.593 1.663 . . . . 95.26 109.171 -168.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -131.45 82.17 2.02 Favored 'General case' 0 C--N 1.285 -2.209 0 N-CA-C 103.601 -2.74 . . . . 100.0 103.601 166.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.64 -25.37 38.74 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 127.891 3.244 . . . . 66.26 109.662 170.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -90.4 -40.92 11.77 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 127.364 2.266 . . . . 95.2 110.458 -159.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.53 -51.72 54.14 Favored Glycine 0 C--N 1.314 -0.683 0 CA-C-N 110.947 -2.842 . . . . 66.32 108.211 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 87.4 m -57.95 -33.92 69.34 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 126.29 1.818 . . . . 71.23 110.693 -171.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -100.86 3.17 41.67 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 116.347 1.98 . . . . 69.8 116.347 -166.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.61 -40.45 87.57 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 125.451 2.548 . . . . 53.27 115.719 -167.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . 0.252 1.3 m -66.97 -37.58 84.51 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 111.618 -2.537 . . . . 70.21 110.109 -176.437 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 8.7 mt -75.62 -44.86 40.62 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.617 -2.083 . . . . 71.19 108.754 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 2.9 t -54.68 -42.64 71.64 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.612 -1.255 . . . . 37.45 107.612 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -67.87 -41.61 82.58 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 106.5 -1.667 . . . . 100.0 106.5 -171.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.15 -36.89 85.51 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 125.359 2.504 . . . . 49.08 111.118 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -96.51 -17.97 20.14 Favored 'General case' 0 C--N 1.286 -2.18 0 C-N-CA 112.097 -3.841 . . . . 74.94 109.174 -171.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' CYS . . . . . 0.644 ' SG ' ' CE2' ' B' ' 145' ' ' TYR . 70.4 m -87.96 -72.24 0.54 Allowed 'General case' 0 C--N 1.312 -1.058 0 O-C-N 125.365 1.666 . . . . 90.38 109.018 -172.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.87 39.1 1.29 Allowed 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 114.768 -2.539 . . . . 82.8 109.618 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . 0.836 ' CE ' ' O ' ' B' ' 182' ' ' HOH . 16.1 mmtt -150.32 -38.1 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 127.478 2.987 . . . . 100.0 114.544 -179.014 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . 13.9 mt -114.99 -7.6 12.53 Favored 'General case' 0 C--N 1.292 -1.921 0 C-N-CA 116.152 -2.219 . . . . 65.4 109.849 165.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HIS . . . . . 0.653 ' CD2' ' O ' ' B' ' 151' ' ' HOH . 97.1 m-70 57.21 50.63 11.4 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.112 0.782 . . . . 95.49 113.112 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 43.0 t -94.22 120.47 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 103.489 -2.782 . . . . 38.4 103.489 -177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -63.65 123.05 80.02 Favored Pre-proline 0 C--N 1.298 -1.639 0 O-C-N 124.5 1.125 . . . . 44.76 108.96 175.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -40.71 -17.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.453 2 C-N-CA 131.312 8.008 . . . . 41.61 116.02 178.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -77.91 -21.1 51.7 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 117.221 -1.792 . . . . 78.25 110.504 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -75.68 -14.47 60.35 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 115.324 -2.551 . . . . 47.04 110.013 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -72.34 -34.74 68.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.15 -1.841 . . . . 60.68 109.812 174.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . 0.67 ' NH2' ' O ' ' B' ' 204' ' ' HOH . 29.9 mtt85 -73.01 -41.84 63.84 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 124.016 1.865 . . . . 98.47 111.949 171.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -55.11 -54.55 41.75 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 113.153 -1.839 . . . . 28.96 114.498 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 12.6 tp -51.16 -52.63 42.33 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 125.436 1.494 . . . . 41.7 109.586 173.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -42.11 -57.39 3.61 Favored Glycine 0 N--CA 1.426 -1.992 0 O-C-N 127.75 3.156 . . . . 30.78 112.691 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -67.87 -28.44 67.53 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 115.252 1.575 . . . . 47.69 115.252 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 2.6 m -77.4 -27.38 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 102.329 -3.212 . . . . 61.34 102.329 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -34.42 77.26 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.888 -1.893 . . . . 57.83 105.888 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 76.6 t -73.66 -32.82 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 114.138 -3.025 . . . . 35.22 109.324 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 57.7 m -60.01 -46.68 88.69 Favored 'General case' 0 C--N 1.29 -2.016 0 C-N-CA 117.611 -1.636 . . . . 42.76 112.565 173.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 70.3 t -61.43 -41.12 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.772 1.629 . . . . 68.82 111.285 -175.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.51 -47.95 65.65 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 127.302 2.877 . . . . 32.47 109.517 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.05 -38.23 65.02 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 115.361 -2.536 . . . . 45.78 114.352 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -70.66 -23.82 62.58 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 107.663 -1.236 . . . . 52.69 107.663 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -94.5 -27.39 16.0 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 116.012 -2.275 . . . . 100.0 109.449 -168.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -107.15 -10.47 15.86 Favored 'General case' 0 C--N 1.267 -2.994 0 CA-C-O 123.712 1.72 . . . . 72.53 111.408 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.47 -113.4 0.59 Allowed Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 114.564 -1.198 . . . . 33.85 115.949 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -70.28 -19.39 63.11 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 106.456 -1.683 . . . . 91.22 106.456 -166.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -74.02 -8.28 55.56 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 124.873 2.273 . . . . 100.0 108.35 -174.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' PHE . . . . . 0.455 ' C ' ' O ' ' B' ' 207' ' ' HOH . 14.3 t80 -100.47 76.32 1.84 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 111.618 -2.537 . . . . 57.57 109.415 175.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' THR . . . . . 0.778 ' N ' ' O ' ' B' ' 207' ' ' HOH . 27.7 p -77.27 163.35 65.14 Favored Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 106.737 -1.579 . . . . 40.86 106.737 -175.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.42 -42.17 70.85 Favored 'Trans proline' 0 C--N 1.293 -2.391 0 C-N-CA 122.698 2.265 . . . . 44.34 113.111 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -63.22 -25.33 72.31 Favored 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 124.421 3.414 . . . . 61.66 112.741 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' VAL . . . . . 0.834 ' CB ' ' O ' ' B' ' 207' ' ' HOH . 75.3 t -88.04 -32.77 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 113.495 -3.282 . . . . 44.56 105.674 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -62.61 -44.71 95.61 Favored 'General case' 0 C--N 1.268 -2.953 0 C-N-CA 115.663 -2.415 . . . . 50.99 112.592 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -53.44 -36.37 61.5 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.496 -1.684 . . . . 50.73 111.046 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.81 -37.09 67.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.339 1.066 . . . . 54.83 110.448 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -75.49 -27.55 58.85 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 112.762 -2.017 . . . . 56.11 109.705 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -70.63 -34.84 72.53 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 126.609 2.443 . . . . 34.86 107.494 -175.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 72.2 mttt -69.05 -28.79 66.86 Favored 'General case' 0 C--N 1.273 -2.734 0 C-N-CA 115.519 -2.473 . . . . 54.96 110.706 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 91.8 t -82.8 -42.54 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 127.087 2.742 . . . . 44.81 108.991 -167.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.46 -37.33 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 127.874 3.233 . . . . 56.52 106.462 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ALA . . . . . 0.414 ' O ' ' ND2' ' B' ' 139' ' ' ASN . . . -57.93 -39.93 79.2 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 124.896 1.372 . . . . 33.64 111.863 171.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.57 -35.87 39.92 Favored Glycine 0 N--CA 1.418 -2.532 1 N-CA-C 101.382 -4.687 . . . . 32.96 101.382 -166.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . 0.251 78.3 t -69.31 -44.19 80.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 109.985 -3.107 . . . . 53.08 109.524 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -63.47 -31.96 73.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 125.779 1.924 . . . . 41.99 108.857 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ASN . . . . . 0.414 ' ND2' ' O ' ' B' ' 135' ' ' ALA . 70.5 m-20 -76.65 -24.48 53.29 Favored 'General case' 0 C--N 1.279 -2.484 0 O-C-N 120.199 -1.563 . . . . 80.98 111.643 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' B' ' 210' ' ' HOH . . . -79.68 -41.02 27.74 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 123.358 1.551 . . . . 64.94 110.258 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . 0.333 6.1 mt -68.8 -32.19 71.74 Favored 'General case' 0 C--N 1.275 -2.643 0 CA-C-N 114.523 -1.217 . . . . 41.8 110.496 177.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.93 14.77 9.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 114.62 -2.832 . . . . 35.02 109.267 -171.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -84.0 -8.63 59.1 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 115.608 -2.437 . . . . 84.08 113.682 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LYS . . . . . 0.785 ' CB ' ' O ' ' B' ' 181' ' ' HOH . 0.0 OUTLIER -98.38 27.64 4.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 114.134 -3.026 . . . . 98.22 111.481 178.327 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' TYR . . . . . 0.644 ' CE2' ' SG ' ' B' ' 93' ' ' CYS . 3.9 m-85 -102.5 -0.31 32.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 125.18 1.392 . . . . 100.0 109.075 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . 0.276 1.0 OUTLIER . . . . . 0 C--O 1.258 1.54 0 C-N-CA 131.036 3.734 . . . . 100.0 112.949 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' A' A ' 154' ' ' HOH . . . . . 0.628 ' O ' ' CD2' ' A' ' 103' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . 1.114 ' O ' ' CB ' ' A' ' 37' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 23' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . 0.745 ' O ' ' CG2' ' A' ' 108' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . 0.857 ' O ' ' CD1' ' A' ' 109' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . 0.919 ' O ' ' OE1' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . 0.864 ' O ' ' OD1' ' A' ' 64' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . 0.649 ' O ' ' OG ' ' A' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' HOH . . . . . 0.653 ' O ' ' CD2' ' B' ' 97' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' HOH . . . . . 0.561 ' O ' ' CG ' ' B' ' 22' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' HOH . . . . . 0.681 ' O ' ' CD ' ' B' ' 43' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' HOH . . . . . 0.785 ' O ' ' CB ' ' B' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' HOH . . . . . 0.836 ' O ' ' CE ' ' B' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' HOH . . . . . 0.428 ' O ' ' CD1' ' B' ' 68' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . 0.67 ' O ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . 0.834 ' O ' ' CB ' ' B' ' 126' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . 0.539 ' O ' ' O ' ' B' ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.313 3.0 p . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 118.029 -0.986 . . . . 81.71 109.063 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 61.5 mt 76.25 113.97 0.07 Allowed 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 124.009 1.861 . . . . 67.33 111.221 -168.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . 0.583 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 96.4 p -98.21 167.92 10.78 Favored Pre-proline 0 C--N 1.292 -1.926 0 CA-C-N 111.673 -2.512 . . . . 79.52 105.919 -167.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . 0.674 ' HA ' ' HD3' ' A' ' 7' ' ' LYS . 20.2 Cg_endo -46.83 -25.09 3.48 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 125.737 2.441 . . . . 53.74 110.806 172.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.62 -23.54 15.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 116.78 -1.968 . . . . 54.02 110.325 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -69.0 -50.02 52.62 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 105.281 -2.118 . . . . 29.92 105.281 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.674 ' HD3' ' HA ' ' A' ' 4' ' ' PRO 0.292 0.0 OUTLIER -58.56 -29.96 66.79 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 126.128 2.142 . . . . 95.17 109.728 178.404 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.3 m -71.74 -43.27 66.12 Favored 'General case' 0 C--N 1.288 -2.099 1 O-C-N 115.557 -4.464 . . . . 43.27 114.863 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . 0.262 80.9 m-20 -67.18 -37.03 83.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 130.407 3.483 . . . . 82.68 111.438 176.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . 0.565 HG22 HD12 ' A' ' 125' ' ' LEU . 23.2 t -78.04 -31.78 16.91 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 C-N-CA 114.37 -2.932 . . . . 45.09 106.966 -179.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -62.54 -20.84 65.05 Favored 'General case' 0 C--N 1.388 2.25 0 O-C-N 127.638 3.086 . . . . 100.0 105.047 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -111.99 -37.31 5.13 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 117.477 2.399 . . . . 61.43 117.477 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.8 -23.88 67.53 Favored 'General case' 0 C--N 1.247 -3.861 0 C-N-CA 112.165 -3.814 . . . . 33.27 110.199 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 -77.77 -39.69 43.24 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 115.784 -2.366 . . . . 100.0 108.492 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -42.38 -59.5 3.05 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 128.122 3.389 . . . . 72.64 110.541 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -62.39 -24.81 67.59 Favored 'General case' 0 C--N 1.276 -2.593 0 C-N-CA 128.948 2.899 . . . . 92.73 116.116 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . 0.553 ' CG2' HD11 ' A' ' 113' ' ' LEU . 4.7 t -76.73 -26.12 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-N 121.342 1.883 . . . . 42.38 113.214 172.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 30.34 -123.93 0.14 Allowed Glycine 0 CA--C 1.535 1.283 0 CA-C-O 124.194 1.997 . . . . 49.29 117.756 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -19.75 65.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 109.116 -3.542 . . . . 58.31 111.171 -169.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -85.92 9.11 17.81 Favored 'General case' 0 C--N 1.293 -1.848 0 C-N-CA 114.326 -2.95 . . . . 86.48 112.021 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.49 85.43 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 115.615 -2.434 . . . . 88.84 111.762 -168.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.74 -36.63 91.51 Favored Glycine 0 N--CA 1.483 1.796 0 O-C-N 125.438 1.711 . . . . 53.43 112.937 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' ' 158' ' ' HOH . 5.4 mt-10 -65.64 -23.77 66.88 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 124.714 2.197 . . . . 100.0 110.804 173.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . 1.124 ' HB3' ' O ' ' A' ' 160' ' ' HOH . 15.8 m-30 -89.96 -27.39 19.84 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 118.685 -2.509 . . . . 65.27 105.25 -173.483 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.3 -15.21 81.75 Favored Glycine 0 N--CA 1.403 -3.52 0 C-N-CA 114.951 -3.499 . . . . 42.9 107.67 -172.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.35 -26.2 18.19 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 103.151 -2.907 . . . . 25.61 103.151 -173.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -75.8 -29.66 58.8 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.401 3.563 . . . . 58.45 108.983 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.354 . . -73.44 -36.29 65.89 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.785 1.755 . . . . 24.49 106.614 -169.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.77 -48.84 75.33 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-N 109.257 -3.61 . . . . 29.21 109.568 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . 0.919 ' OE1' ' O ' ' A' ' 163' ' ' HOH . 35.5 tt0 -57.1 -49.58 75.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 126.114 2.134 . . . . 75.17 112.885 175.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HD3' ' OE1' ' B' ' 127' ' ' GLN . 90.0 mtt-85 -48.4 -39.22 21.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.963 -1.017 . . . . 53.44 112.924 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.0 ttp -77.8 -40.79 39.47 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 125.075 1.485 . . . . 22.55 109.504 -168.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -62.8 -33.75 75.84 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.801 -2.0 . . . . 59.79 106.905 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.79 -41.84 25.69 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.947 2.654 . . . . 72.74 111.222 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . 0.623 ' HB3' ' HG3' ' B' ' 131' ' ' GLN . 25.6 m -90.77 -34.54 15.3 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 126.441 3.02 . . . . 31.92 111.489 -166.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -123.77 84.96 53.73 Favored Pre-proline 0 C--N 1.287 -2.129 0 CA-C-N 110.647 -2.979 . . . . 44.11 110.057 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . 1.252 ' HB3' ' O ' ' A' ' 155' ' ' HOH . 48.1 Cg_exo -69.95 -9.46 26.09 Favored 'Trans proline' 0 C--N 1.293 -2.389 0 C-N-CA 121.983 1.788 . . . . 43.44 111.161 -167.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -26.09 60.3 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 123.716 1.722 . . . . 46.82 110.246 -176.04 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.4 p -66.04 -28.8 69.13 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 112.968 -1.924 . . . . 34.16 110.05 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm -50.31 -18.5 0.62 Allowed 'General case' 0 N--CA 1.481 1.118 0 O-C-N 125.867 1.979 . . . . 59.59 114.182 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.73 -19.98 65.87 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.962 1.305 . . . . 45.66 113.848 -174.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . 0.565 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 91.6 m-85 -89.03 -13.74 38.07 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 118.143 -1.423 . . . . 65.17 109.684 -173.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -121.25 50.09 1.99 Allowed Pre-proline 0 N--CA 1.431 -1.379 0 CA-C-N 111.5 -2.591 . . . . 54.38 111.126 -165.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . 0.565 ' HD3' ' C ' ' A' ' 42' ' ' TYR . 3.0 Cg_exo -80.93 -2.34 11.74 Favored 'Trans proline' 0 C--N 1.318 -1.057 0 C-N-CA 117.145 -1.437 . . . . 70.51 109.503 -166.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -110.7 14.04 22.35 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 127.231 3.396 . . . . 70.4 107.532 -174.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . 0.624 ' HB3' HD13 ' A' ' 48' ' ' LEU . 5.8 m-85 -111.97 143.63 42.64 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 110.785 -2.916 . . . . 62.12 108.538 176.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -79.0 119.19 21.79 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 111.453 -2.612 . . . . 57.27 104.612 159.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . 0.624 HD13 ' HB3' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -103.19 24.66 10.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.796 1.284 . . . . 61.6 107.649 -172.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -95.49 163.93 13.02 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-N 113.424 -1.716 . . . . 45.92 107.438 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -43.64 -64.65 0.61 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 126.688 2.492 . . . . 86.32 111.968 -163.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.8 19.2 38.83 Favored Glycine 0 N--CA 1.48 1.583 0 C-N-CA 115.335 -3.317 . . . . 51.97 111.428 -166.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.6 t -64.26 120.72 12.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 123.361 1.553 . . . . 62.46 113.327 -174.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.63 -36.98 62.62 Favored 'General case' 0 C--N 1.301 -1.53 2 CA-C-N 106.732 -4.758 . . . . 57.08 109.642 175.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -73.33 -47.24 44.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 106.789 -1.56 . . . . 59.71 106.789 -172.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.16 -32.94 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 126.071 2.107 . . . . 27.99 112.561 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -45.8 91.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 125.077 2.37 . . . . 78.48 109.158 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.51 -13.53 82.47 Favored Glycine 0 C--N 1.272 -3.009 0 CA-C-N 111.42 -2.627 . . . . 38.42 109.82 -169.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -81.59 -47.82 12.57 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 127.292 2.407 . . . . 62.16 112.21 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -35.15 -46.21 0.67 Allowed Glycine 0 N--CA 1.439 -1.139 0 C-N-CA 128.513 2.959 . . . . 33.91 107.2 162.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -65.49 -40.17 92.75 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 126.09 1.7 . . . . 58.48 106.634 -170.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -71.45 -47.86 53.04 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 128.008 3.317 . . . . 89.62 111.294 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.72 -48.56 83.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 126.649 2.468 . . . . 28.91 107.367 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.14 91.95 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.706 1.254 . . . . 44.39 113.579 -174.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . 0.864 ' OD1' ' O ' ' A' ' 180' ' ' HOH . 98.6 m-20 -63.18 -37.79 88.61 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 127.063 2.727 . . . . 60.55 110.504 174.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.71 -24.6 58.78 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 116.248 -2.181 . . . . 37.14 108.875 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.467 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.6 mt -71.32 -37.04 71.77 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 116.809 -1.956 . . . . 41.12 110.227 177.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 48.0 m -74.2 -31.5 62.67 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 124.995 1.434 . . . . 59.86 109.874 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -71.39 -36.94 71.57 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 104.171 -2.529 . . . . 97.63 104.171 177.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.46 -43.9 97.69 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 120.114 1.325 . . . . 30.09 113.806 172.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' LEU . 3.5 t -58.67 -43.06 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.83 0 CA-C-O 124.383 2.04 . . . . 34.57 111.129 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . 0.318 . . -97.6 89.02 4.51 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 113.315 -3.231 . . . . 48.14 104.946 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.3 m80 119.82 17.08 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.101 0 C-N-CA 130.972 3.709 . . . . 84.66 107.537 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HE3' ' A' ' 76' ' ' MET . 9.1 p -47.48 -30.88 2.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 116.723 -1.608 . . . . 35.31 112.763 173.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -93.03 11.35 27.84 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 106.515 -1.661 . . . . 81.08 106.515 -173.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -165.28 45.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 128.765 3.791 . . . . 90.25 115.703 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . 0.622 ' HE3' HG23 ' A' ' 73' ' ' VAL . 49.3 mtt -58.95 -46.31 99.54 Favored Pre-proline 0 C--N 1.301 -1.506 0 CA-C-N 113.038 -1.892 . . . . 66.35 111.42 171.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . 0.459 ' HD2' ' N ' ' A' ' 76' ' ' MET . 9.3 Cg_endo -43.6 -57.34 1.88 Allowed 'Trans proline' 0 CA--C 1.555 1.545 0 CA-C-N 120.585 1.245 . . . . 47.93 112.201 179.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -68.92 -26.6 65.17 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 121.926 2.148 . . . . 89.0 110.717 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -81.24 -33.26 32.93 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 117.329 -1.748 . . . . 69.86 111.478 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.459 HD12 HG11 ' A' ' 135' ' ' VAL . 9.0 mt -102.67 12.23 36.61 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 104.162 -2.532 . . . . 49.53 104.162 -172.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 84' ' ' SER . 10.8 p -35.53 -62.96 0.38 Allowed 'General case' 0 C--N 1.321 -0.671 0 O-C-N 128.324 3.515 . . . . 85.67 112.165 176.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.36 -33.68 61.08 Favored 'General case' 0 C--O 1.208 -1.089 0 C-N-CA 117.85 -1.54 . . . . 66.87 114.797 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.503 HD21 HBA2 ' A' ' 143' ' ' HEM . 69.7 mt -61.17 -27.96 68.78 Favored 'General case' 0 C--N 1.279 -2.467 0 O-C-N 117.136 -3.478 . . . . 65.51 114.445 170.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 81' ' ' SER . 13.9 m -61.28 -48.39 81.63 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 123.878 1.799 . . . . 51.44 108.286 174.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 1.3 m-20 -62.79 -51.12 68.33 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 116.353 -1.784 . . . . 94.06 111.401 178.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -43.93 95.2 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 127.236 2.835 . . . . 74.53 110.812 -179.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -80.35 -38.09 31.18 Favored 'General case' 0 C--N 1.297 -1.708 0 C-N-CA 112.715 -3.594 . . . . 35.39 113.143 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -92.03 -35.29 14.03 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 124.245 0.966 . . . . 56.83 110.85 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HIS . . . . . 0.579 ' HB2' ' O ' ' A' ' 85' ' ' ASP . 12.5 m-70 -77.54 -65.56 0.95 Allowed 'General case' 0 CA--C 1.478 -1.802 0 C-N-CA 117.375 -1.73 . . . . 100.0 112.755 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -77.74 -42.35 34.55 Favored 'General case' 0 C--N 1.303 -1.416 2 O-C-N 132.849 6.343 . . . . 96.11 108.989 -167.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 90.2 mt -97.25 -21.04 17.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 114.815 -2.754 . . . . 61.81 113.784 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HG3' HH11 ' A' ' 92' ' ' ARG . 0.0 OUTLIER 55.47 54.57 8.33 Favored 'General case' 0 C--O 1.252 1.202 0 CA-C-O 118.034 -0.984 . . . . 77.26 110.598 -179.086 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.7 t -75.99 135.01 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 126.247 2.217 . . . . 53.73 112.175 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -71.89 127.98 90.0 Favored Pre-proline 0 C--N 1.303 -1.448 0 N-CA-C 103.986 -2.598 . . . . 24.87 103.986 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -62.65 -21.92 73.42 Favored 'Trans proline' 0 C--N 1.284 -2.851 0 C-N-CA 123.102 2.534 . . . . 39.65 107.762 -170.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -24.63 32.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.992 0 O-C-N 126.989 2.681 . . . . 60.77 107.091 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -67.35 -21.9 65.61 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 117.016 -1.873 . . . . 25.11 114.649 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -72.3 -31.3 65.58 Favored 'General case' 0 C--N 1.274 -2.711 0 CA-C-O 117.539 -1.22 . . . . 34.9 111.436 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -72.32 -38.58 68.64 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 127.061 2.726 . . . . 74.9 111.588 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 49.1 mt -69.77 -36.39 75.72 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 119.552 1.069 . . . . 46.39 113.66 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.1 tp -69.69 -40.95 76.05 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 124.567 1.167 . . . . 39.55 108.764 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.0 m -63.61 -33.7 76.19 Favored 'General case' 0 CA--C 1.491 -1.32 0 O-C-N 126.712 2.508 . . . . 30.24 109.809 -171.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 75.7 t60 -72.24 -41.48 66.74 Favored 'General case' 0 C--N 1.273 -2.757 0 O-C-N 127.46 2.975 . . . . 54.49 108.999 178.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 90.6 m -69.34 -36.61 77.09 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 114.194 -3.003 . . . . 31.59 113.898 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -46.71 -48.33 20.3 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 123.895 0.878 . . . . 23.77 113.163 162.814 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.49 -48.02 51.74 Favored 'General case' 0 C--N 1.359 0.991 0 O-C-N 119.186 -2.196 . . . . 33.14 112.29 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 70.7 t -45.36 -40.15 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 126.377 1.871 . . . . 60.61 109.659 167.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 0.745 ' CG2' ' O ' ' A' ' 160' ' ' HOH . 17.7 m -77.37 -35.15 54.78 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 119.528 -1.983 . . . . 30.91 111.24 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . 0.857 ' CD1' ' O ' ' A' ' 161' ' ' HOH . 0.0 OUTLIER -65.66 -50.84 63.48 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.826 1.648 . . . . 41.2 107.947 177.592 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -52.19 -39.66 60.45 Favored 'General case' 0 N--CA 1.48 1.026 1 O-C-N 129.637 4.336 . . . . 34.99 112.56 177.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.93 -8.71 59.69 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 127.159 2.787 . . . . 42.48 104.715 -166.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 -116.61 -27.08 6.81 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 127.053 2.721 . . . . 56.16 112.687 -169.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' CG2' ' A' ' 17' ' ' VAL 0.254 50.2 mt -137.06 66.07 53.08 Favored Pre-proline 0 N--CA 1.49 1.543 0 CA-C-O 114.329 -2.748 . . . . 55.5 112.464 -165.895 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -81.44 -13.59 10.88 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.682 2.921 . . . . 69.77 112.964 -160.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.51 -46.05 60.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.329 1.643 . . . . 39.4 108.636 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -81.74 -32.3 31.6 Favored 'General case' 0 N--CA 1.49 1.525 2 O-C-N 129.6 4.312 . . . . 97.56 113.254 -169.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -82.51 55.07 2.81 Favored 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 126.656 2.473 . . . . 43.19 108.954 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 38.3 p -63.66 152.73 85.5 Favored Pre-proline 0 N--CA 1.485 1.319 0 O-C-N 127.504 3.002 . . . . 89.76 110.581 171.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -42.37 -34.04 2.89 Favored 'Trans proline' 0 C--O 1.24 0.615 1 C-N-CA 126.062 4.508 . . . . 39.85 111.25 169.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -87.79 -22.59 24.44 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 125.749 1.906 . . . . 46.05 110.28 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 31.7 t -87.5 -28.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 C-N-CA 115.526 -2.47 . . . . 32.54 107.622 -178.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -59.46 -45.58 91.22 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 128.04 3.338 . . . . 21.33 106.763 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.31 97.3 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 115.747 -2.073 . . . . 55.18 113.637 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.3 m -68.18 -34.16 75.79 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 127.18 2.8 . . . . 47.74 107.13 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . 0.565 HD12 HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -78.49 -50.21 12.04 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 111.026 -2.806 . . . . 44.9 107.753 -173.708 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -43.54 -52.6 6.12 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 117.435 -1.706 . . . . 43.3 115.429 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -63.63 -47.08 82.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 128.819 3.824 . . . . 69.68 107.413 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . 0.476 ' CE1' ' HE1' ' A' ' 76' ' ' MET . 56.2 t80 -57.49 -40.99 79.84 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 114.969 -2.692 . . . . 34.69 112.371 173.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.36 -22.99 58.95 Favored 'General case' 0 C--N 1.288 -2.085 0 C-N-CA 114.578 -2.849 . . . . 33.08 107.955 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.99 64.99 Favored 'General case' 0 C--N 1.287 -2.141 0 O-C-N 127.018 2.699 . . . . 41.01 110.968 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.4 m -83.08 -37.71 23.48 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 118.01 -1.476 . . . . 48.37 108.554 -171.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 66.6 t -58.48 -43.77 87.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 109.554 -3.475 . . . . 38.22 112.664 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.2 m -67.22 -38.84 85.93 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 126.111 2.132 . . . . 35.44 109.295 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.0 m -65.42 -41.32 93.68 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 126.276 2.235 . . . . 52.65 112.474 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . 0.459 HG11 HD12 ' A' ' 80' ' ' LEU . 12.0 t -57.99 -50.33 78.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 126.153 2.158 . . . . 31.43 111.611 169.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 89.5 mt -78.66 1.57 22.39 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-N 120.013 1.279 . . . . 54.17 112.037 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 19.0 p -120.37 11.83 11.55 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.13 -1.606 . . . . 44.96 112.532 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' SER . . . . . 0.504 ' HA ' ' HD2' ' A' ' 141' ' ' ARG . 97.5 p -89.21 -5.0 58.02 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 125.119 1.367 . . . . 74.4 109.384 -167.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . 0.306 9.7 tttt -92.34 -1.93 56.72 Favored 'General case' 0 C--O 1.244 0.774 1 C-N-CA 108.477 -5.289 . . . . 100.0 109.747 166.347 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.7 -16.85 59.4 Favored 'General case' 0 N--CA 1.532 3.649 0 C-N-CA 116.63 -2.028 . . . . 100.0 115.166 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . 0.504 ' HD2' ' HA ' ' A' ' 138' ' ' SER . 82.7 mtt-85 . . . . . 0 C--N 1.318 -0.782 0 C-N-CA 128.802 2.841 . . . . 100.0 109.146 -172.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' VAL . . . . . 0.651 HG21 ' HB3' ' B' ' 78' ' ' LEU . 1.6 m . . . . . 0 C--O 1.24 0.578 0 CA-C-O 124.48 2.086 . . . . 79.18 114.396 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' HIS . . . . . 0.451 ' N ' HG23 ' B' ' 1' ' ' VAL 0.338 10.3 t-160 -127.65 -71.2 0.67 Allowed 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 110.012 -3.267 . . . . 100.0 104.376 168.799 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.33 115.8 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.838 2 O-C-N 130.926 5.141 . . . . 62.35 107.308 -177.154 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HD2' ' B' ' 5' ' ' PRO . 1.4 p -83.97 165.6 38.32 Favored Pre-proline 0 C--N 1.3 -1.574 1 C-N-CA 110.908 -4.317 . . . . 82.25 101.105 -174.039 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 5' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' B' ' 4' ' ' THR . 9.3 Cg_endo -42.09 -48.79 6.19 Favored 'Trans proline' 0 C--N 1.294 -2.336 0 C-N-CA 124.636 3.557 . . . . 62.28 112.893 178.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 0.436 ' HG3' ' OG1' ' B' ' 4' ' ' THR . 1.3 pt-20 -70.64 -41.89 71.58 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 126.116 2.135 . . . . 85.37 110.295 -174.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.23 -45.64 92.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 127.196 2.81 . . . . 62.36 109.878 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' O ' ' HB ' ' B' ' 12' ' ' THR . 3.9 mmtt -53.56 -44.66 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 125.615 1.822 . . . . 81.55 107.379 175.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -33.76 76.26 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 106.097 -1.816 . . . . 60.26 106.097 -168.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -35.65 20.76 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 127.363 2.914 . . . . 78.87 113.731 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.94 -41.82 85.05 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.182 0 N-CA-C 115.198 1.555 . . . . 55.13 115.198 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' B' ' 8' ' ' LYS 0.5 1.1 m -73.45 -47.91 37.8 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 130.787 3.635 . . . . 60.42 110.788 -175.024 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.12 68.05 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.155 -1.839 . . . . 56.83 115.708 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . 0.601 HD11 ' HD1' ' B' ' 122' ' ' PHE . 4.4 mt -83.62 -38.38 21.65 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 119.987 1.267 . . . . 76.2 111.181 175.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -66.57 -31.66 72.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.597 3.686 . . . . 66.36 113.264 -170.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.1 -46.8 92.23 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 129.006 3.941 . . . . 69.17 111.377 169.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . 0.478 ' HE2' ' O ' ' B' ' 171' ' ' HOH . 29.9 mttt -64.48 -31.32 72.49 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.621 1.712 . . . . 75.54 115.621 174.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 4.5 t -62.94 122.76 14.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 N-CA-C 114.263 1.209 . . . . 42.76 114.263 -169.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -66.76 96.82 0.42 Allowed 'General case' 0 N--CA 1.49 1.544 1 O-C-N 129.707 4.38 . . . . 62.48 107.296 172.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -15.8 15.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 123.857 0.723 . . . . 95.58 112.39 -176.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASP . . . . . 0.521 ' HA ' ' HD2' ' B' ' 65' ' ' LYS . 1.2 m-20 -77.29 -32.6 55.54 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 114.156 -3.018 . . . . 85.46 108.701 173.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' B' ' 172' ' ' HOH . 1.6 mm-40 -112.9 -0.18 14.94 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 114.928 -2.709 . . . . 100.0 110.647 -169.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 26.6 t -92.15 -35.45 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 119.154 -2.216 . . . . 55.97 109.179 -175.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLY . . . . . 0.517 ' HA3' ' O ' ' B' ' 64' ' ' GLY . . . -61.37 -32.65 81.72 Favored Glycine 0 N--CA 1.485 1.937 0 O-C-N 125.922 2.013 . . . . 40.4 112.313 -176.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -85.25 -29.41 27.94 Favored Glycine 0 N--CA 1.442 -0.965 0 O-C-N 126.542 1.966 . . . . 42.32 110.731 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.63 68.16 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 106.732 -1.581 . . . . 56.98 106.732 174.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ALA . . . . . 0.847 ' HB2' HG21 ' B' ' 113' ' ' VAL . . . -81.59 -37.1 28.17 Favored 'General case' 0 C--N 1.283 -2.313 0 C-N-CA 113.385 -3.326 . . . . 46.95 116.938 176.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . 0.573 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -63.18 -32.86 74.35 Favored 'General case' 0 N--CA 1.506 2.372 0 CA-C-N 119.871 1.214 . . . . 59.01 111.109 171.744 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.45 -44.45 41.61 Favored Glycine 0 C--N 1.291 -1.941 0 C-N-CA 117.802 -2.142 . . . . 45.26 108.903 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.7 mtt-85 -61.99 -30.96 71.29 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.578 -0.811 . . . . 48.92 109.876 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . 0.539 HD22 HD13 ' B' ' 106' ' ' LEU . 18.7 tp -67.27 -35.31 79.24 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 126.385 2.303 . . . . 48.35 109.47 178.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' B' ' 28' ' ' LEU . 16.1 mt -82.73 -20.55 35.79 Favored 'General case' 0 CA--C 1.491 -1.294 0 C-N-CA 113.659 -3.216 . . . . 50.39 103.866 -166.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.94 -37.04 9.15 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 105.444 -2.058 . . . . 56.84 105.444 -173.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 38.9 t -82.54 -35.04 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 114.534 -2.867 . . . . 39.63 108.35 -168.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -122.5 85.89 48.49 Favored Pre-proline 0 C--O 1.243 0.726 0 CA-C-N 112.8 -2.0 . . . . 49.6 108.119 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.78 -25.98 39.08 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 123.892 3.062 . . . . 67.35 110.749 -164.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 42.8 p90 -59.0 -32.61 69.85 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 114.874 -2.73 . . . . 48.33 108.438 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 55.6 p -65.03 -19.36 65.96 Favored 'General case' 0 C--N 1.309 -1.195 0 O-C-N 126.883 2.615 . . . . 52.49 110.739 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLN . . . . . 0.546 ' HG3' ' HB3' ' B' ' 32' ' ' LEU . 40.5 mt-30 -68.22 -14.2 62.81 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 114.637 -2.601 . . . . 75.69 110.85 176.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -34.96 -34.75 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 120.734 1.606 . . . . 93.31 110.178 162.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PHE . . . . . 0.628 ' CE2' HG22 ' B' ' 98' ' ' VAL . 67.0 m-85 -94.46 -7.04 42.56 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.984 -1.008 . . . . 66.29 112.649 -161.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -133.84 39.49 3.15 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 125.441 1.713 . . . . 51.19 111.8 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . 0.681 ' CD ' ' O ' ' B' ' 174' ' ' HOH . 46.6 mt-10 -65.5 -27.55 68.56 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.108 -0.951 . . . . 98.3 109.177 173.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 11.8 p -70.11 -8.44 49.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.87 2.068 . . . . 94.12 111.127 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . 0.257 2.2 m-30 -101.5 -8.63 21.77 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 117.127 -1.416 . . . . 57.58 114.334 -167.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.18 -165.8 12.07 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 114.249 -3.834 . . . . 54.2 112.855 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.54 121.52 16.55 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 116.859 -1.936 . . . . 81.65 107.31 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' B' ' 54' ' ' VAL . 14.9 mt -124.79 37.56 4.38 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 126.272 2.232 . . . . 58.18 109.082 166.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.9 t -95.84 -8.45 34.13 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 112.753 -3.579 . . . . 97.75 105.82 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.81 146.17 54.01 Favored Pre-proline 0 C--N 1.264 -3.123 0 N-CA-C 103.82 -2.659 . . . . 80.68 103.82 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -69.06 -16.42 40.5 Favored 'Trans proline' 0 C--N 1.285 -2.768 0 C-N-CA 121.551 1.5 . . . . 48.43 110.749 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -74.85 -40.79 60.81 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.087 2.117 . . . . 82.96 107.448 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.48 -16.59 63.81 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 111.084 -2.78 . . . . 100.0 112.322 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' B' ' 48' ' ' LEU . 89.9 t -88.27 -31.12 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 117.707 -1.597 . . . . 85.34 108.109 177.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' MET . . . . . . . . . . . . . 23.7 mmt -93.4 -8.78 40.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 114.072 -3.051 . . . . 83.59 113.299 -166.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -119.58 34.46 4.23 Favored Glycine 0 N--CA 1.482 1.706 0 O-C-N 127.348 2.905 . . . . 75.66 110.974 170.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' B' ' 58' ' ' PRO . 19.5 t-20 -100.66 129.37 27.77 Favored Pre-proline 0 N--CA 1.434 -1.267 0 N-CA-C 105.975 -1.861 . . . . 74.21 105.975 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' PRO . . . . . 0.634 ' HA ' ' HG2' ' B' ' 61' ' ' LYS . 31.9 Cg_exo -81.46 -24.56 4.3 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 C-N-CA 123.917 3.078 . . . . 100.0 108.68 -164.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' B' ' 62' ' ' ALA . 9.0 mttp -74.82 -33.87 62.27 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 125.716 1.885 . . . . 82.78 106.863 178.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.91 -43.66 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 127.263 2.852 . . . . 66.97 110.413 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' HA ' ' B' ' 58' ' ' PRO . 15.4 pttt -76.34 -22.48 54.84 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.202 0.939 . . . . 100.0 110.683 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' B' ' 58' ' ' PRO . . . -71.94 -32.53 67.41 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 122.757 1.265 . . . . 68.71 109.224 -179.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' B' ' 66' ' ' LYS . 80.8 t60 -90.56 -34.4 15.52 Favored 'General case' 0 N--CA 1.412 -2.325 0 CA-C-N 110.682 -2.963 . . . . 54.89 109.478 -170.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLY . . . . . 0.517 ' O ' ' HA3' ' B' ' 24' ' ' GLY . . . -66.45 -19.17 68.5 Favored Glycine 0 N--CA 1.501 2.99 0 CA-C-N 110.726 -2.943 . . . . 35.71 114.011 -174.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' B' ' 21' ' ' ASP . 14.5 tttm -83.17 -29.57 28.49 Favored 'General case' 0 C--O 1.25 1.106 0 C-N-CA 116.795 -1.962 . . . . 100.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . 0.549 ' HA ' ' CE ' ' B' ' 66' ' ' LYS . 0.0 OUTLIER -60.08 -43.73 95.3 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 104.375 -2.454 . . . . 100.0 104.375 174.425 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.6 t -71.41 -25.67 25.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 O-C-N 126.099 2.124 . . . . 38.8 110.472 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . 0.74 HD13 ' O ' ' B' ' 196' ' ' HOH 0.271 17.3 mt -82.24 -21.74 36.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 111.921 -3.912 . . . . 66.31 107.444 -178.708 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -48.71 -65.98 2.36 Favored Glycine 0 C--O 1.245 0.835 1 O-C-N 131.006 5.191 . . . . 46.97 106.079 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -26.97 39.87 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.066 2.274 . . . . 74.61 110.993 -176.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -76.65 -36.89 57.1 Favored 'General case' 0 C--N 1.344 0.344 0 O-C-N 124.798 1.311 . . . . 62.77 109.397 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -67.98 -41.17 82.73 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 127.109 2.756 . . . . 71.14 104.839 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . 0.68 ' O ' ' HB2' ' B' ' 77' ' ' HIS . 0.1 OUTLIER -58.46 -47.79 82.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 112.736 -2.029 . . . . 92.64 111.276 170.752 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.77 -40.06 32.33 Favored Glycine 0 C--N 1.314 -0.69 1 C-N-CA 113.149 -4.358 . . . . 53.13 112.196 -174.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LEU . . . . . 0.752 ' CD1' HG11 ' B' ' 133' ' ' VAL . 17.4 tp -55.7 -24.45 34.54 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 127.177 2.34 . . . . 84.31 111.83 -169.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -137.35 57.17 1.75 Allowed 'General case' 0 C--N 1.316 -0.889 0 O-C-N 126.043 2.089 . . . . 98.3 110.329 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HIS . . . . . 0.68 ' HB2' ' O ' ' B' ' 73' ' ' ASP . 0.6 OUTLIER -171.08 34.63 0.02 OUTLIER 'General case' 0 C--O 1.246 0.875 2 C-N-CA 133.178 4.591 . . . . 95.95 109.063 178.871 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . 0.651 ' HB3' HG21 ' B' ' 1' ' ' VAL . 34.9 mt -71.71 -2.26 16.77 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 117.905 -1.518 . . . . 73.85 110.793 -168.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -86.62 -32.65 20.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.593 1.663 . . . . 95.26 109.171 -168.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -131.45 82.17 2.02 Favored 'General case' 0 C--N 1.285 -2.209 0 N-CA-C 103.601 -2.74 . . . . 100.0 103.601 166.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LEU . . . . . 0.581 HD22 ' CG1' ' B' ' 1' ' ' VAL . 0.0 OUTLIER -55.64 -25.37 38.74 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 127.891 3.244 . . . . 66.26 109.662 170.531 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -90.4 -40.92 11.77 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 127.364 2.266 . . . . 95.2 110.458 -159.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.53 -51.72 54.14 Favored Glycine 0 C--N 1.314 -0.683 0 CA-C-N 110.947 -2.842 . . . . 66.32 108.211 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 87.4 m -57.95 -33.92 69.34 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 126.29 1.818 . . . . 71.23 110.693 -171.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -100.86 3.17 41.67 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 116.347 1.98 . . . . 69.8 116.347 -166.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.61 -40.45 87.57 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 125.451 2.548 . . . . 53.27 115.719 -167.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . 0.252 1.3 m -66.97 -37.58 84.51 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 111.618 -2.537 . . . . 70.21 110.109 -176.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 8.7 mt -75.62 -44.86 40.62 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.617 -2.083 . . . . 71.19 108.754 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' SER . . . . . 0.416 ' OG ' ' HB2' ' B' ' 144' ' ' LYS . 2.9 t -54.68 -42.64 71.64 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.612 -1.255 . . . . 37.45 107.612 172.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -67.87 -41.61 82.58 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 106.5 -1.667 . . . . 100.0 106.5 -171.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.15 -36.89 85.51 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 125.359 2.504 . . . . 49.08 111.118 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HIS . . . . . 0.541 ' HA ' HD12 ' B' ' 96' ' ' LEU . 77.5 m80 -96.51 -17.97 20.14 Favored 'General case' 0 C--N 1.286 -2.18 0 C-N-CA 112.097 -3.841 . . . . 74.94 109.174 -171.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' CYS . . . . . 0.636 ' SG ' ' CE2' ' B' ' 145' ' ' TYR . 70.4 m -87.96 -72.24 0.54 Allowed 'General case' 0 C--N 1.312 -1.058 0 O-C-N 125.365 1.666 . . . . 90.38 109.018 -172.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.87 39.1 1.29 Allowed 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 114.768 -2.539 . . . . 82.8 109.618 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . 0.935 ' HE2' ' O ' ' B' ' 182' ' ' HOH . 16.1 mmtt -150.32 -38.1 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 127.478 2.987 . . . . 100.0 114.544 -179.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' B' ' 92' ' ' HIS . 13.9 mt -114.99 -7.6 12.53 Favored 'General case' 0 C--N 1.292 -1.921 0 C-N-CA 116.152 -2.219 . . . . 65.4 109.849 165.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HIS . . . . . 0.827 ' HD2' ' O ' ' B' ' 151' ' ' HOH . 97.1 m-70 57.21 50.63 11.4 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.112 0.782 . . . . 95.49 113.112 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . 0.628 HG22 ' CE2' ' B' ' 41' ' ' PHE . 43.0 t -94.22 120.47 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 103.489 -2.782 . . . . 38.4 103.489 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . 0.446 ' HA ' ' HD2' ' B' ' 100' ' ' PRO . 12.2 t70 -63.65 123.05 80.02 Favored Pre-proline 0 C--N 1.298 -1.639 0 O-C-N 124.5 1.125 . . . . 44.76 108.96 175.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' PRO . . . . . 0.669 ' HD3' ' CE2' ' B' ' 145' ' ' TYR . 3.0 Cg_exo -40.71 -17.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.453 2 C-N-CA 131.312 8.008 . . . . 41.61 116.02 178.377 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . 0.623 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 8.4 tp10 -77.91 -21.1 51.7 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 117.221 -1.792 . . . . 78.25 110.504 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -75.68 -14.47 60.35 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 115.324 -2.551 . . . . 47.04 110.013 176.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 100' ' ' PRO . 17.9 m-30 -72.34 -34.74 68.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.15 -1.841 . . . . 60.68 109.812 174.314 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 0.67 ' NH2' ' O ' ' B' ' 204' ' ' HOH . 29.9 mtt85 -73.01 -41.84 63.84 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 124.016 1.865 . . . . 98.47 111.949 171.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' B' ' 101' ' ' GLU . 17.6 mt -55.11 -54.55 41.75 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 113.153 -1.839 . . . . 28.96 114.498 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . 0.539 HD13 HD22 ' B' ' 31' ' ' LEU . 12.6 tp -51.16 -52.63 42.33 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 125.436 1.494 . . . . 41.7 109.586 173.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -42.11 -57.39 3.61 Favored Glycine 0 N--CA 1.426 -1.992 0 O-C-N 127.75 3.156 . . . . 30.78 112.691 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -67.87 -28.44 67.53 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 115.252 1.575 . . . . 47.69 115.252 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 105' ' ' LEU . 2.6 m -77.4 -27.38 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 102.329 -3.212 . . . . 61.34 102.329 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -34.42 77.26 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.888 -1.893 . . . . 57.83 105.888 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 76.6 t -73.66 -32.82 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 114.138 -3.025 . . . . 35.22 109.324 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 57.7 m -60.01 -46.68 88.69 Favored 'General case' 0 C--N 1.29 -2.016 0 C-N-CA 117.611 -1.636 . . . . 42.76 112.565 173.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' VAL . . . . . 0.847 HG21 ' HB2' ' B' ' 27' ' ' ALA . 70.3 t -61.43 -41.12 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.772 1.629 . . . . 68.82 111.285 -175.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.51 -47.95 65.65 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 127.302 2.877 . . . . 32.47 109.517 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.05 -38.23 65.02 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 115.361 -2.536 . . . . 45.78 114.352 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -70.66 -23.82 62.58 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 107.663 -1.236 . . . . 52.69 107.663 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -94.5 -27.39 16.0 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 116.012 -2.275 . . . . 100.0 109.449 -168.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -107.15 -10.47 15.86 Favored 'General case' 0 C--N 1.267 -2.994 0 CA-C-O 123.712 1.72 . . . . 72.53 111.408 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.47 -113.4 0.59 Allowed Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 114.564 -1.198 . . . . 33.85 115.949 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -70.28 -19.39 63.11 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 106.456 -1.683 . . . . 91.22 106.456 -166.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -74.02 -8.28 55.56 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 124.873 2.273 . . . . 100.0 108.35 -174.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' PHE . . . . . 0.601 ' HD1' HD11 ' B' ' 14' ' ' LEU . 14.3 t80 -100.47 76.32 1.84 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 111.618 -2.537 . . . . 57.57 109.415 175.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' THR . . . . . 0.778 ' N ' ' O ' ' B' ' 207' ' ' HOH . 27.7 p -77.27 163.35 65.14 Favored Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 106.737 -1.579 . . . . 40.86 106.737 -175.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.42 -42.17 70.85 Favored 'Trans proline' 0 C--N 1.293 -2.391 0 C-N-CA 122.698 2.265 . . . . 44.34 113.111 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -63.22 -25.33 72.31 Favored 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 124.421 3.414 . . . . 61.66 112.741 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' VAL . . . . . 1.293 ' HB ' ' O ' ' B' ' 207' ' ' HOH . 75.3 t -88.04 -32.77 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 113.495 -3.282 . . . . 44.56 105.674 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLN . . . . . 0.48 ' OE1' ' HD3' ' A' ' 31' ' ' ARG . 19.8 tt0 -62.61 -44.71 95.61 Favored 'General case' 0 C--N 1.268 -2.953 0 C-N-CA 115.663 -2.415 . . . . 50.99 112.592 175.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' B' ' 132' ' ' LYS . . . -53.44 -36.37 61.5 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.496 -1.684 . . . . 50.73 111.046 173.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ALA . . . . . 0.563 ' O ' HG23 ' B' ' 133' ' ' VAL . . . -72.81 -37.09 67.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.339 1.066 . . . . 54.83 110.448 -178.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -75.49 -27.55 58.85 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 112.762 -2.017 . . . . 56.11 109.705 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . 0.623 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 13.7 mm100 -70.63 -34.84 72.53 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 126.609 2.443 . . . . 34.86 107.494 -175.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' B' ' 128' ' ' ALA . 72.2 mttt -69.05 -28.79 66.86 Favored 'General case' 0 C--N 1.273 -2.734 0 C-N-CA 115.519 -2.473 . . . . 54.96 110.706 -177.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' VAL . . . . . 0.752 HG11 ' CD1' ' B' ' 75' ' ' LEU . 91.8 t -82.8 -42.54 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 127.087 2.742 . . . . 44.81 108.991 -167.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.46 -37.33 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 127.874 3.233 . . . . 56.52 106.462 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ALA . . . . . 0.414 ' O ' ' ND2' ' B' ' 139' ' ' ASN . . . -57.93 -39.93 79.2 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 124.896 1.372 . . . . 33.64 111.863 171.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.57 -35.87 39.92 Favored Glycine 0 N--CA 1.418 -2.532 1 N-CA-C 101.382 -4.687 . . . . 32.96 101.382 -166.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . 0.251 78.3 t -69.31 -44.19 80.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 109.985 -3.107 . . . . 53.08 109.524 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -63.47 -31.96 73.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 125.779 1.924 . . . . 41.99 108.857 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ASN . . . . . 0.414 ' ND2' ' O ' ' B' ' 135' ' ' ALA . 70.5 m-20 -76.65 -24.48 53.29 Favored 'General case' 0 C--N 1.279 -2.484 0 O-C-N 120.199 -1.563 . . . . 80.98 111.643 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' B' ' 210' ' ' HOH . . . -79.68 -41.02 27.74 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 123.358 1.551 . . . . 64.94 110.258 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . 0.333 6.1 mt -68.8 -32.19 71.74 Favored 'General case' 0 C--N 1.275 -2.643 0 CA-C-N 114.523 -1.217 . . . . 41.8 110.496 177.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.93 14.77 9.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 114.62 -2.832 . . . . 35.02 109.267 -171.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -84.0 -8.63 59.1 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 115.608 -2.437 . . . . 84.08 113.682 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LYS . . . . . 0.788 ' HB2' ' O ' ' B' ' 181' ' ' HOH . 0.0 OUTLIER -98.38 27.64 4.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 114.134 -3.026 . . . . 98.22 111.481 178.327 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 145' ' ' TYR . . . . . 0.669 ' CE2' ' HD3' ' B' ' 100' ' ' PRO . 3.9 m-85 -102.5 -0.31 32.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 125.18 1.392 . . . . 100.0 109.075 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . 0.276 1.0 OUTLIER . . . . . 0 C--O 1.258 1.54 0 C-N-CA 131.036 3.734 . . . . 100.0 112.949 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HEM . . . . . 0.522 HAD1 ' O ' ' A' ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 147' ' ' HEM . . . . . 0.622 HBD1 ' HHA' ' B' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.516 ' O ' ' HD2' ' A' ' 7' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . 1.252 ' O ' ' HB3' ' A' ' 37' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 23' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . 1.124 ' O ' ' HB3' ' A' ' 24' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . 0.857 ' O ' ' CD1' ' A' ' 109' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . 0.919 ' O ' ' OE1' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . 0.864 ' O ' ' OD1' ' A' ' 64' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . 0.522 ' O ' HAD1 ' A' ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 151' ' ' HOH . . . . . 0.827 ' O ' ' HD2' ' B' ' 97' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 171' ' ' HOH . . . . . 0.478 ' O ' ' HE2' ' B' ' 17' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' HOH . . . . . 0.561 ' O ' ' CG ' ' B' ' 22' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 174' ' ' HOH . . . . . 0.681 ' O ' ' CD ' ' B' ' 43' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 181' ' ' HOH . . . . . 0.788 ' O ' ' HB2' ' B' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' HOH . . . . . 0.935 ' O ' ' HE2' ' B' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 196' ' ' HOH . . . . . 0.74 ' O ' HD13 ' B' ' 68' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . 0.6 ' O ' ' HG3' ' B' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . 0.67 ' O ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . 1.293 ' O ' ' HB ' ' B' ' 126' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . 0.539 ' O ' ' O ' ' B' ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.313 3.0 p . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 118.029 -0.986 . . . . 81.71 109.063 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 61.5 mt 76.25 113.97 0.07 Allowed 'General case' 0 N--CA 1.492 1.669 0 CA-C-O 124.009 1.861 . . . . 67.33 111.221 -168.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . 0.583 ' HB2' ' HD2' ' A' ' 4' ' ' PRO . 96.4 p -98.21 167.92 10.78 Favored Pre-proline 0 C--N 1.292 -1.926 0 CA-C-N 111.673 -2.512 . . . . 79.52 105.919 -167.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.674 ' HA ' ' HD3' ' A' ' 7' ' ' LYS . 20.2 Cg_endo -46.83 -25.09 3.48 Favored 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 125.737 2.441 . . . . 53.74 110.806 172.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -97.62 -23.54 15.93 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 116.78 -1.968 . . . . 54.02 110.325 -176.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -69.0 -50.02 52.62 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 105.281 -2.118 . . . . 29.92 105.281 176.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.674 ' HD3' ' HA ' ' A' ' 4' ' ' PRO 0.292 0.0 OUTLIER -58.56 -29.96 66.79 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 126.128 2.142 . . . . 95.17 109.728 178.404 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 49.3 m -71.74 -43.27 66.12 Favored 'General case' 0 C--N 1.288 -2.099 1 O-C-N 115.557 -4.464 . . . . 43.27 114.863 177.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . 0.262 5.4 m120 -67.18 -37.03 83.03 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 130.407 3.483 . . . . 82.68 111.438 176.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.565 HG22 HD12 ' A' ' 125' ' ' LEU . 23.2 t -78.04 -31.78 16.91 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 C-N-CA 114.37 -2.932 . . . . 45.09 106.966 -179.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.5 mttt -62.54 -20.84 65.05 Favored 'General case' 0 C--N 1.388 2.25 0 O-C-N 127.638 3.086 . . . . 100.0 105.047 178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -111.99 -37.31 5.13 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 117.477 2.399 . . . . 61.43 117.477 -165.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.8 -23.88 67.53 Favored 'General case' 0 C--N 1.247 -3.861 0 C-N-CA 112.165 -3.814 . . . . 33.27 110.199 170.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.8 t-105 -77.77 -39.69 43.24 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 115.784 -2.366 . . . . 100.0 108.492 -179.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -42.38 -59.5 3.05 Favored Glycine 0 N--CA 1.472 1.096 0 O-C-N 128.122 3.389 . . . . 72.64 110.541 173.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt -62.39 -24.81 67.59 Favored 'General case' 0 C--N 1.276 -2.593 0 C-N-CA 128.948 2.899 . . . . 92.73 116.116 177.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.553 ' CG2' HD11 ' A' ' 113' ' ' LEU . 4.7 t -76.73 -26.12 16.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 CA-C-N 121.342 1.883 . . . . 42.38 113.214 172.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 30.34 -123.93 0.14 Allowed Glycine 0 CA--C 1.535 1.283 0 CA-C-O 124.194 1.997 . . . . 49.29 117.756 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.31 -19.75 65.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 109.116 -3.542 . . . . 58.31 111.171 -169.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -85.92 9.11 17.81 Favored 'General case' 0 C--N 1.293 -1.848 0 C-N-CA 114.326 -2.95 . . . . 86.48 112.021 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.49 -41.49 85.43 Favored 'General case' 0 C--O 1.245 0.845 0 C-N-CA 115.615 -2.434 . . . . 88.84 111.762 -168.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.74 -36.63 91.51 Favored Glycine 0 N--CA 1.483 1.796 0 O-C-N 125.438 1.711 . . . . 53.43 112.937 176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.656 ' OE2' ' O ' ' A' ' 158' ' ' HOH . 5.4 mt-10 -65.64 -23.77 66.88 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 124.714 2.197 . . . . 100.0 110.804 173.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . 1.124 ' HB3' ' O ' ' A' ' 160' ' ' HOH . 15.8 m-30 -89.96 -27.39 19.84 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 118.685 -2.509 . . . . 65.27 105.25 -173.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -77.3 -15.21 81.75 Favored Glycine 0 N--CA 1.403 -3.52 0 C-N-CA 114.951 -3.499 . . . . 42.9 107.67 -172.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -92.35 -26.2 18.19 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 103.151 -2.907 . . . . 25.61 103.151 -173.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.9 tt0 -75.8 -29.66 58.8 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 128.401 3.563 . . . . 58.45 108.983 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.354 . . -73.44 -36.29 65.89 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-O 123.785 1.755 . . . . 24.49 106.614 -169.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.77 -48.84 75.33 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-N 109.257 -3.61 . . . . 29.21 109.568 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.919 ' OE1' ' O ' ' A' ' 163' ' ' HOH . 35.5 tt0 -57.1 -49.58 75.44 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 126.114 2.134 . . . . 75.17 112.885 175.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.48 ' HD3' ' OE1' ' B' ' 127' ' ' GLN . 90.0 mtt-85 -48.4 -39.22 21.71 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.963 -1.017 . . . . 53.44 112.924 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.0 ttp -77.8 -40.79 39.47 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 125.075 1.485 . . . . 22.55 109.504 -168.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -62.8 -33.75 75.84 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 112.801 -2.0 . . . . 59.79 106.905 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.4 mp -79.79 -41.84 25.69 Favored 'General case' 0 C--N 1.319 -0.734 0 O-C-N 126.947 2.654 . . . . 72.74 111.222 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . 0.623 ' HB3' ' HG3' ' B' ' 131' ' ' GLN . 25.6 m -90.77 -34.54 15.3 Favored 'General case' 0 C--N 1.364 1.206 0 CA-C-O 126.441 3.02 . . . . 31.92 111.489 -166.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -123.77 84.96 53.73 Favored Pre-proline 0 C--N 1.287 -2.129 0 CA-C-N 110.647 -2.979 . . . . 44.11 110.057 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . 1.252 ' HB3' ' O ' ' A' ' 155' ' ' HOH . 48.1 Cg_exo -69.95 -9.46 26.09 Favored 'Trans proline' 0 C--N 1.293 -2.389 0 C-N-CA 121.983 1.788 . . . . 43.44 111.161 -167.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -73.95 -26.09 60.3 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 123.716 1.722 . . . . 46.82 110.246 -176.04 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 69.4 p -66.04 -28.8 69.13 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 112.968 -1.924 . . . . 34.16 110.05 -177.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.8 mtmm -50.31 -18.5 0.62 Allowed 'General case' 0 N--CA 1.481 1.118 0 O-C-N 125.867 1.979 . . . . 59.59 114.182 -179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.73 -19.98 65.87 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.962 1.305 . . . . 45.66 113.848 -174.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.565 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 91.6 m-85 -89.03 -13.74 38.07 Favored 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 118.143 -1.423 . . . . 65.17 109.684 -173.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -121.25 50.09 1.99 Allowed Pre-proline 0 N--CA 1.431 -1.379 0 CA-C-N 111.5 -2.591 . . . . 54.38 111.126 -165.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.565 ' HD3' ' C ' ' A' ' 42' ' ' TYR . 3.0 Cg_exo -80.93 -2.34 11.74 Favored 'Trans proline' 0 C--N 1.318 -1.057 0 C-N-CA 117.145 -1.437 . . . . 70.51 109.503 -166.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -110.7 14.04 22.35 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 127.231 3.396 . . . . 70.4 107.532 -174.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.624 ' HB3' HD13 ' A' ' 48' ' ' LEU . 5.8 m-85 -111.97 143.63 42.64 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 110.785 -2.916 . . . . 62.12 108.538 176.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -79.0 119.19 21.79 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 111.453 -2.612 . . . . 57.27 104.612 159.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.624 HD13 ' HB3' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -103.19 24.66 10.54 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 122.796 1.284 . . . . 61.6 107.649 -172.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.1 p -95.49 163.93 13.02 Favored 'General case' 0 C--N 1.285 -2.237 0 CA-C-N 113.424 -1.716 . . . . 45.92 107.438 -174.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -43.64 -64.65 0.61 Allowed 'General case' 0 C--N 1.31 -1.129 0 O-C-N 126.688 2.492 . . . . 86.32 111.968 -163.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -88.8 19.2 38.83 Favored Glycine 0 N--CA 1.48 1.583 0 C-N-CA 115.335 -3.317 . . . . 51.97 111.428 -166.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 28.6 t -64.26 120.72 12.69 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 123.361 1.553 . . . . 62.46 113.327 -174.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.63 -36.98 62.62 Favored 'General case' 0 C--N 1.301 -1.53 2 CA-C-N 106.732 -4.758 . . . . 57.08 109.642 175.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -73.33 -47.24 44.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 106.789 -1.56 . . . . 59.71 106.789 -172.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.0 t -63.16 -32.94 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 O-C-N 126.071 2.107 . . . . 27.99 112.561 169.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -45.8 91.8 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 125.077 2.37 . . . . 78.48 109.158 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.51 -13.53 82.47 Favored Glycine 0 C--N 1.272 -3.009 0 CA-C-N 111.42 -2.627 . . . . 38.42 109.82 -169.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -81.59 -47.82 12.57 Favored 'General case' 0 C--O 1.212 -0.913 0 O-C-N 127.292 2.407 . . . . 62.16 112.21 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -35.15 -46.21 0.67 Allowed Glycine 0 N--CA 1.439 -1.139 0 C-N-CA 128.513 2.959 . . . . 33.91 107.2 162.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.0 mttt -65.49 -40.17 92.75 Favored 'General case' 0 C--N 1.36 1.023 0 O-C-N 126.09 1.7 . . . . 58.48 106.634 -170.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -71.45 -47.86 53.04 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 128.008 3.317 . . . . 89.62 111.294 -175.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -57.72 -48.56 83.22 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 O-C-N 126.649 2.468 . . . . 28.91 107.367 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.14 91.95 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.706 1.254 . . . . 44.39 113.579 -174.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.864 ' OD1' ' O ' ' A' ' 180' ' ' HOH . 98.6 m-20 -63.18 -37.79 88.61 Favored 'General case' 0 C--N 1.304 -1.376 0 O-C-N 127.063 2.727 . . . . 60.55 110.504 174.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.71 -24.6 58.78 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 116.248 -2.181 . . . . 37.14 108.875 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.467 ' O ' HG23 ' A' ' 70' ' ' VAL . 11.6 mt -71.32 -37.04 71.77 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 116.809 -1.956 . . . . 41.12 110.227 177.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 48.0 m -74.2 -31.5 62.67 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 124.995 1.434 . . . . 59.86 109.874 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -71.39 -36.94 71.57 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 104.171 -2.529 . . . . 97.63 104.171 177.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.46 -43.9 97.69 Favored 'General case' 0 CA--C 1.567 1.612 0 CA-C-N 120.114 1.325 . . . . 30.09 113.806 172.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' LEU . 3.5 t -58.67 -43.06 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.83 0 CA-C-O 124.383 2.04 . . . . 34.57 111.129 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . 0.318 . . -97.6 89.02 4.51 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 113.315 -3.231 . . . . 48.14 104.946 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.3 m80 119.82 17.08 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.101 0 C-N-CA 130.972 3.709 . . . . 84.66 107.537 -174.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.622 HG23 ' HE3' ' A' ' 76' ' ' MET . 9.1 p -47.48 -30.88 2.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 CA-C-O 116.723 -1.608 . . . . 35.31 112.763 173.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -93.03 11.35 27.84 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 106.515 -1.661 . . . . 81.08 106.515 -173.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -165.28 45.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 128.765 3.791 . . . . 90.25 115.703 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . 0.622 ' HE3' HG23 ' A' ' 73' ' ' VAL . 49.3 mtt -58.95 -46.31 99.54 Favored Pre-proline 0 C--N 1.301 -1.506 0 CA-C-N 113.038 -1.892 . . . . 66.35 111.42 171.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.459 ' HD2' ' N ' ' A' ' 76' ' ' MET . 9.3 Cg_endo -43.6 -57.34 1.88 Allowed 'Trans proline' 0 CA--C 1.555 1.545 0 CA-C-N 120.585 1.245 . . . . 47.93 112.201 179.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -68.92 -26.6 65.17 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 121.926 2.148 . . . . 89.0 110.717 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -81.24 -33.26 32.93 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 117.329 -1.748 . . . . 69.86 111.478 -171.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.459 HD12 HG11 ' A' ' 135' ' ' VAL . 9.0 mt -102.67 12.23 36.61 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 104.162 -2.532 . . . . 49.53 104.162 -172.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 0.411 ' O ' ' HB2' ' A' ' 84' ' ' SER . 10.8 p -35.53 -62.96 0.38 Allowed 'General case' 0 C--N 1.321 -0.671 0 O-C-N 128.324 3.515 . . . . 85.67 112.165 176.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -75.36 -33.68 61.08 Favored 'General case' 0 C--O 1.208 -1.089 0 C-N-CA 117.85 -1.54 . . . . 66.87 114.797 -176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.503 HD21 HBA2 ' A' ' 143' ' ' HEM . 69.7 mt -61.17 -27.96 68.78 Favored 'General case' 0 C--N 1.279 -2.467 0 O-C-N 117.136 -3.478 . . . . 65.51 114.445 170.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 81' ' ' SER . 13.9 m -61.28 -48.39 81.63 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 123.878 1.799 . . . . 51.44 108.286 174.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 1.3 m-20 -62.79 -51.12 68.33 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-O 116.353 -1.784 . . . . 94.06 111.401 178.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.1 -43.93 95.2 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 127.236 2.835 . . . . 74.53 110.812 -179.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -80.35 -38.09 31.18 Favored 'General case' 0 C--N 1.297 -1.708 0 C-N-CA 112.715 -3.594 . . . . 35.39 113.143 -176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -92.03 -35.29 14.03 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 124.245 0.966 . . . . 56.83 110.85 -173.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.594 ' HE1' ' HD3' ' A' ' 139' ' ' LYS . 3.9 m80 -77.54 -65.56 0.95 Allowed 'General case' 0 CA--C 1.478 -1.802 0 C-N-CA 117.375 -1.73 . . . . 100.0 112.755 179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 39.0 tttt -77.74 -42.35 34.55 Favored 'General case' 0 C--N 1.303 -1.416 2 O-C-N 132.849 6.343 . . . . 96.11 108.989 -167.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 90.2 mt -97.25 -21.04 17.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 114.815 -2.754 . . . . 61.81 113.784 -177.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HG3' HH11 ' A' ' 92' ' ' ARG . 0.0 OUTLIER 55.47 54.57 8.33 Favored 'General case' 0 C--O 1.252 1.202 0 CA-C-O 118.034 -0.984 . . . . 77.26 110.598 -179.086 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.7 t -75.99 135.01 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 126.247 2.217 . . . . 53.73 112.175 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -71.89 127.98 90.0 Favored Pre-proline 0 C--N 1.303 -1.448 0 N-CA-C 103.986 -2.598 . . . . 24.87 103.986 -176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -62.65 -21.92 73.42 Favored 'Trans proline' 0 C--N 1.284 -2.851 0 C-N-CA 123.102 2.534 . . . . 39.65 107.762 -170.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.89 -24.63 32.84 Favored 'Isoleucine or valine' 0 C--O 1.248 0.992 0 O-C-N 126.989 2.681 . . . . 60.77 107.091 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -67.35 -21.9 65.61 Favored 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 117.016 -1.873 . . . . 25.11 114.649 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -72.3 -31.3 65.58 Favored 'General case' 0 C--N 1.274 -2.711 0 CA-C-O 117.539 -1.22 . . . . 34.9 111.436 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -72.32 -38.58 68.64 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 127.061 2.726 . . . . 74.9 111.588 176.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 49.1 mt -69.77 -36.39 75.72 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 119.552 1.069 . . . . 46.39 113.66 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.1 tp -69.69 -40.95 76.05 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 124.567 1.167 . . . . 39.55 108.764 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.0 m -63.61 -33.7 76.19 Favored 'General case' 0 CA--C 1.491 -1.32 0 O-C-N 126.712 2.508 . . . . 30.24 109.809 -171.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.823 ' HD2' ' O ' ' A' ' 154' ' ' HOH . 28.2 t-80 -72.24 -41.48 66.74 Favored 'General case' 0 C--N 1.273 -2.757 0 O-C-N 127.46 2.975 . . . . 54.49 108.999 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 90.6 m -69.34 -36.61 77.09 Favored 'General case' 0 C--O 1.243 0.747 0 C-N-CA 114.194 -3.003 . . . . 31.59 113.898 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -46.71 -48.33 20.3 Favored 'General case' 0 C--N 1.284 -2.282 0 C-N-CA 123.895 0.878 . . . . 23.77 113.163 162.814 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.49 -48.02 51.74 Favored 'General case' 0 C--N 1.359 0.991 0 O-C-N 119.186 -2.196 . . . . 33.14 112.29 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 70.7 t -45.36 -40.15 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.389 0 C-N-CA 126.377 1.871 . . . . 60.61 109.659 167.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 0.745 ' CG2' ' O ' ' A' ' 160' ' ' HOH . 17.7 m -77.37 -35.15 54.78 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 119.528 -1.983 . . . . 30.91 111.24 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.857 ' CD1' ' O ' ' A' ' 161' ' ' HOH . 0.0 OUTLIER -65.66 -50.84 63.48 Favored 'General case' 0 N--CA 1.527 3.422 0 CA-C-N 120.826 1.648 . . . . 41.2 107.947 177.592 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -52.19 -39.66 60.45 Favored 'General case' 0 N--CA 1.48 1.026 1 O-C-N 129.637 4.336 . . . . 34.99 112.56 177.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -81.93 -8.71 59.69 Favored 'General case' 0 CA--C 1.512 -0.504 0 O-C-N 127.159 2.787 . . . . 42.48 104.715 -166.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 -116.61 -27.08 6.81 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 127.053 2.721 . . . . 56.16 112.687 -169.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.553 HD11 ' CG2' ' A' ' 17' ' ' VAL 0.254 50.2 mt -137.06 66.07 53.08 Favored Pre-proline 0 N--CA 1.49 1.543 0 CA-C-O 114.329 -2.748 . . . . 55.5 112.464 -165.895 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -81.44 -13.59 10.88 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.682 2.921 . . . . 69.77 112.964 -160.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.51 -46.05 60.73 Favored 'General case' 0 N--CA 1.448 -0.566 0 O-C-N 125.329 1.643 . . . . 39.4 108.636 176.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -81.74 -32.3 31.6 Favored 'General case' 0 N--CA 1.49 1.525 2 O-C-N 129.6 4.312 . . . . 97.56 113.254 -169.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -82.51 55.07 2.81 Favored 'General case' 0 N--CA 1.442 -0.84 0 O-C-N 126.656 2.473 . . . . 43.19 108.954 -172.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 38.3 p -63.66 152.73 85.5 Favored Pre-proline 0 N--CA 1.485 1.319 0 O-C-N 127.504 3.002 . . . . 89.76 110.581 171.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -42.37 -34.04 2.89 Favored 'Trans proline' 0 C--O 1.24 0.615 1 C-N-CA 126.062 4.508 . . . . 39.85 111.25 169.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -87.79 -22.59 24.44 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 125.749 1.906 . . . . 46.05 110.28 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 31.7 t -87.5 -28.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 C-N-CA 115.526 -2.47 . . . . 32.54 107.622 -178.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -59.46 -45.58 91.22 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 128.04 3.338 . . . . 21.33 106.763 176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -61.52 -44.31 97.3 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 115.747 -2.073 . . . . 55.18 113.637 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 22.3 m -68.18 -34.16 75.79 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 127.18 2.8 . . . . 47.74 107.13 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.565 HD12 HG22 ' A' ' 10' ' ' VAL . 0.1 OUTLIER -78.49 -50.21 12.04 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 111.026 -2.806 . . . . 44.9 107.753 -173.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -43.54 -52.6 6.12 Favored 'General case' 0 N--CA 1.421 -1.892 0 C-N-CA 117.435 -1.706 . . . . 43.3 115.429 170.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 40.9 mttm -63.63 -47.08 82.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 128.819 3.824 . . . . 69.68 107.413 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.476 ' CE1' ' HE1' ' A' ' 76' ' ' MET . 56.2 t80 -57.49 -40.99 79.84 Favored 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 114.969 -2.692 . . . . 34.69 112.371 173.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 13.8 mt -74.36 -22.99 58.95 Favored 'General case' 0 C--N 1.288 -2.085 0 C-N-CA 114.578 -2.849 . . . . 33.08 107.955 -171.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.99 64.99 Favored 'General case' 0 C--N 1.287 -2.141 0 O-C-N 127.018 2.699 . . . . 41.01 110.968 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.4 m -83.08 -37.71 23.48 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 118.01 -1.476 . . . . 48.37 108.554 -171.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 66.6 t -58.48 -43.77 87.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 CA-C-N 109.554 -3.475 . . . . 38.22 112.664 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 50.2 m -67.22 -38.84 85.93 Favored 'General case' 0 C--N 1.359 1.01 0 O-C-N 126.111 2.132 . . . . 35.44 109.295 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.0 m -65.42 -41.32 93.68 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 126.276 2.235 . . . . 52.65 112.474 -179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.459 HG11 HD12 ' A' ' 80' ' ' LEU . 12.0 t -57.99 -50.33 78.33 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.552 0 O-C-N 126.153 2.158 . . . . 31.43 111.611 169.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 89.5 mt -78.66 1.57 22.39 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-N 120.013 1.279 . . . . 54.17 112.037 -173.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 19.0 p -120.37 11.83 11.55 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.13 -1.606 . . . . 44.96 112.532 175.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' SER . . . . . 0.504 ' HA ' ' HD2' ' A' ' 141' ' ' ARG . 97.5 p -89.21 -5.0 58.02 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 125.119 1.367 . . . . 74.4 109.384 -167.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.594 ' HD3' ' HE1' ' A' ' 89' ' ' HIS 0.306 9.7 tttt -92.34 -1.93 56.72 Favored 'General case' 0 C--O 1.244 0.774 1 C-N-CA 108.477 -5.289 . . . . 100.0 109.747 166.347 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.7 -16.85 59.4 Favored 'General case' 0 N--CA 1.532 3.649 0 C-N-CA 116.63 -2.028 . . . . 100.0 115.166 159.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.504 ' HD2' ' HA ' ' A' ' 138' ' ' SER . 82.7 mtt-85 . . . . . 0 C--N 1.318 -0.782 0 C-N-CA 128.802 2.841 . . . . 100.0 109.146 -172.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' VAL . . . . . 0.651 HG21 ' HB3' ' B' ' 78' ' ' LEU . 1.6 m . . . . . 0 C--O 1.24 0.578 0 CA-C-O 124.48 2.086 . . . . 79.18 114.396 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' HIS . . . . . 0.451 ' N ' HG23 ' B' ' 1' ' ' VAL 0.338 10.3 t-160 -127.65 -71.2 0.67 Allowed 'General case' 0 N--CA 1.432 -1.348 0 CA-C-N 110.012 -3.267 . . . . 100.0 104.376 168.799 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.33 115.8 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.838 2 O-C-N 130.926 5.141 . . . . 62.35 107.308 -177.154 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . 0.478 ' HB ' ' HD2' ' B' ' 5' ' ' PRO . 1.4 p -83.97 165.6 38.32 Favored Pre-proline 0 C--N 1.3 -1.574 1 C-N-CA 110.908 -4.317 . . . . 82.25 101.105 -174.039 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.478 ' HD2' ' HB ' ' B' ' 4' ' ' THR . 9.3 Cg_endo -42.09 -48.79 6.19 Favored 'Trans proline' 0 C--N 1.294 -2.336 0 C-N-CA 124.636 3.557 . . . . 62.28 112.893 178.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.436 ' HG3' ' OG1' ' B' ' 4' ' ' THR . 1.3 pt-20 -70.64 -41.89 71.58 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 126.116 2.135 . . . . 85.37 110.295 -174.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -62.23 -45.64 92.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 127.196 2.81 . . . . 62.36 109.878 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' O ' ' HB ' ' B' ' 12' ' ' THR . 3.9 mmtt -53.56 -44.66 69.47 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 125.615 1.822 . . . . 81.55 107.379 175.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -33.76 76.26 Favored 'General case' 0 C--N 1.35 0.611 0 N-CA-C 106.097 -1.816 . . . . 60.26 106.097 -168.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -85.67 -35.65 20.76 Favored 'General case' 0 CA--C 1.545 0.777 0 O-C-N 127.363 2.914 . . . . 78.87 113.731 -169.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.94 -41.82 85.05 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.182 0 N-CA-C 115.198 1.555 . . . . 55.13 115.198 175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . 0.476 ' HB ' ' O ' ' B' ' 8' ' ' LYS 0.5 1.1 m -73.45 -47.91 37.8 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 130.787 3.635 . . . . 60.42 110.788 -175.024 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -25.12 68.05 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.155 -1.839 . . . . 56.83 115.708 175.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.601 HD11 ' HD1' ' B' ' 122' ' ' PHE . 4.4 mt -83.62 -38.38 21.65 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 119.987 1.267 . . . . 76.2 111.181 175.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 19.5 t-105 -66.57 -31.66 72.51 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 128.597 3.686 . . . . 66.36 113.264 -170.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.1 -46.8 92.23 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 129.006 3.941 . . . . 69.17 111.377 169.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.478 ' HE2' ' O ' ' B' ' 171' ' ' HOH . 29.9 mttt -64.48 -31.32 72.49 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 115.621 1.712 . . . . 75.54 115.621 174.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 4.5 t -62.94 122.76 14.42 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 N-CA-C 114.263 1.209 . . . . 42.76 114.263 -169.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -66.76 96.82 0.42 Allowed 'General case' 0 N--CA 1.49 1.544 1 O-C-N 129.707 4.38 . . . . 62.48 107.296 172.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -76.32 -15.8 15.08 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 123.857 0.723 . . . . 95.58 112.39 -176.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.521 ' HA ' ' HD2' ' B' ' 65' ' ' LYS . 1.2 m-20 -77.29 -32.6 55.54 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 114.156 -3.018 . . . . 85.46 108.701 173.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' B' ' 172' ' ' HOH . 1.6 mm-40 -112.9 -0.18 14.94 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 114.928 -2.709 . . . . 100.0 110.647 -169.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 26.6 t -92.15 -35.45 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 119.154 -2.216 . . . . 55.97 109.179 -175.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.517 ' HA3' ' O ' ' B' ' 64' ' ' GLY . . . -61.37 -32.65 81.72 Favored Glycine 0 N--CA 1.485 1.937 0 O-C-N 125.922 2.013 . . . . 40.4 112.313 -176.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . -85.25 -29.41 27.94 Favored Glycine 0 N--CA 1.442 -0.965 0 O-C-N 126.542 1.966 . . . . 42.32 110.731 -174.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.63 68.16 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 106.732 -1.581 . . . . 56.98 106.732 174.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ALA . . . . . 0.847 ' HB2' HG21 ' B' ' 113' ' ' VAL . . . -81.59 -37.1 28.17 Favored 'General case' 0 C--N 1.283 -2.313 0 C-N-CA 113.385 -3.326 . . . . 46.95 116.938 176.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . 0.573 ' O ' ' HG ' ' B' ' 32' ' ' LEU . 0.1 OUTLIER -63.18 -32.86 74.35 Favored 'General case' 0 N--CA 1.506 2.372 0 CA-C-N 119.871 1.214 . . . . 59.01 111.109 171.744 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . -72.45 -44.45 41.61 Favored Glycine 0 C--N 1.291 -1.941 0 C-N-CA 117.802 -2.142 . . . . 45.26 108.903 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 27.7 mtt-85 -61.99 -30.96 71.29 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 114.578 -0.811 . . . . 48.92 109.876 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.539 HD22 HD13 ' B' ' 106' ' ' LEU . 18.7 tp -67.27 -35.31 79.24 Favored 'General case' 0 CA--C 1.501 -0.905 0 O-C-N 126.385 2.303 . . . . 48.35 109.47 178.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' B' ' 28' ' ' LEU . 16.1 mt -82.73 -20.55 35.79 Favored 'General case' 0 CA--C 1.491 -1.294 0 C-N-CA 113.659 -3.216 . . . . 50.39 103.866 -166.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.94 -37.04 9.15 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 105.444 -2.058 . . . . 56.84 105.444 -173.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 38.9 t -82.54 -35.04 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 114.534 -2.867 . . . . 39.63 108.35 -168.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -122.5 85.89 48.49 Favored Pre-proline 0 C--O 1.243 0.726 0 CA-C-N 112.8 -2.0 . . . . 49.6 108.119 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.78 -25.98 39.08 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 123.892 3.062 . . . . 67.35 110.749 -164.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.77 ' HE1' HD21 ' B' ' 102' ' ' ASN . 42.8 p90 -59.0 -32.61 69.85 Favored 'General case' 0 N--CA 1.432 -1.346 0 C-N-CA 114.874 -2.73 . . . . 48.33 108.438 -175.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 55.6 p -65.03 -19.36 65.96 Favored 'General case' 0 C--N 1.309 -1.195 0 O-C-N 126.883 2.615 . . . . 52.49 110.739 -171.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLN . . . . . 0.546 ' HG3' ' HB3' ' B' ' 32' ' ' LEU . 40.5 mt-30 -68.22 -14.2 62.81 Favored 'General case' 0 N--CA 1.479 1.011 0 CA-C-O 114.637 -2.601 . . . . 75.69 110.85 176.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -34.96 -34.75 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 CA-C-N 120.734 1.606 . . . . 93.31 110.178 162.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PHE . . . . . 0.628 ' CE2' HG22 ' B' ' 98' ' ' VAL . 67.0 m-85 -94.46 -7.04 42.56 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 117.984 -1.008 . . . . 66.29 112.649 -161.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -133.84 39.49 3.15 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 125.441 1.713 . . . . 51.19 111.8 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . 0.681 ' CD ' ' O ' ' B' ' 174' ' ' HOH . 46.6 mt-10 -65.5 -27.55 68.56 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.108 -0.951 . . . . 98.3 109.177 173.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 11.8 p -70.11 -8.44 49.59 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.87 2.068 . . . . 94.12 111.127 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . 0.257 2.2 m-30 -101.5 -8.63 21.77 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 117.127 -1.416 . . . . 57.58 114.334 -167.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 113.18 -165.8 12.07 Favored Glycine 0 N--CA 1.47 0.913 0 C-N-CA 114.249 -3.834 . . . . 54.2 112.855 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -68.54 121.52 16.55 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 116.859 -1.936 . . . . 81.65 107.31 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.422 ' HB3' HG22 ' B' ' 54' ' ' VAL . 14.9 mt -124.79 37.56 4.38 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 126.272 2.232 . . . . 58.18 109.082 166.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 7.9 t -95.84 -8.45 34.13 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 112.753 -3.579 . . . . 97.75 105.82 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.81 146.17 54.01 Favored Pre-proline 0 C--N 1.264 -3.123 0 N-CA-C 103.82 -2.659 . . . . 80.68 103.82 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -69.06 -16.42 40.5 Favored 'Trans proline' 0 C--N 1.285 -2.768 0 C-N-CA 121.551 1.5 . . . . 48.43 110.749 -172.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -74.85 -40.79 60.81 Favored 'General case' 0 CA--C 1.505 -0.787 0 O-C-N 126.087 2.117 . . . . 82.96 107.448 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.48 -16.59 63.81 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 111.084 -2.78 . . . . 100.0 112.322 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . 0.422 HG22 ' HB3' ' B' ' 48' ' ' LEU . 89.9 t -88.27 -31.12 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 117.707 -1.597 . . . . 85.34 108.109 177.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' MET . . . . . . . . . . . . . 23.7 mmt -93.4 -8.78 40.8 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 114.072 -3.051 . . . . 83.59 113.299 -166.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -119.58 34.46 4.23 Favored Glycine 0 N--CA 1.482 1.706 0 O-C-N 127.348 2.905 . . . . 75.66 110.974 170.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASN . . . . . 0.434 ' HA ' ' HD3' ' B' ' 58' ' ' PRO . 19.5 t-20 -100.66 129.37 27.77 Favored Pre-proline 0 N--CA 1.434 -1.267 0 N-CA-C 105.975 -1.861 . . . . 74.21 105.975 174.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' PRO . . . . . 0.634 ' HA ' ' HG2' ' B' ' 61' ' ' LYS . 31.9 Cg_exo -81.46 -24.56 4.3 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 C-N-CA 123.917 3.078 . . . . 100.0 108.68 -164.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' B' ' 62' ' ' ALA . 9.0 mttp -74.82 -33.87 62.27 Favored 'General case' 0 C--O 1.245 0.822 0 O-C-N 125.716 1.885 . . . . 82.78 106.863 178.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.91 -43.66 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 O-C-N 127.263 2.852 . . . . 66.97 110.413 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' HA ' ' B' ' 58' ' ' PRO . 15.4 pttt -76.34 -22.48 54.84 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 124.202 0.939 . . . . 100.0 110.683 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' B' ' 58' ' ' PRO . . . -71.94 -32.53 67.41 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 122.757 1.265 . . . . 68.71 109.224 -179.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' B' ' 66' ' ' LYS . 80.8 t60 -90.56 -34.4 15.52 Favored 'General case' 0 N--CA 1.412 -2.325 0 CA-C-N 110.682 -2.963 . . . . 54.89 109.478 -170.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.517 ' O ' ' HA3' ' B' ' 24' ' ' GLY . . . -66.45 -19.17 68.5 Favored Glycine 0 N--CA 1.501 2.99 0 CA-C-N 110.726 -2.943 . . . . 35.71 114.011 -174.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.521 ' HD2' ' HA ' ' B' ' 21' ' ' ASP . 14.5 tttm -83.17 -29.57 28.49 Favored 'General case' 0 C--O 1.25 1.106 0 C-N-CA 116.795 -1.962 . . . . 100.0 109.798 177.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . 0.549 ' HA ' ' CE ' ' B' ' 66' ' ' LYS . 0.0 OUTLIER -60.08 -43.73 95.3 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 104.375 -2.454 . . . . 100.0 104.375 174.425 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.6 t -71.41 -25.67 25.37 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 O-C-N 126.099 2.124 . . . . 38.8 110.472 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.74 HD13 ' O ' ' B' ' 196' ' ' HOH 0.271 17.3 mt -82.24 -21.74 36.17 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 111.921 -3.912 . . . . 66.31 107.444 -178.708 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -48.71 -65.98 2.36 Favored Glycine 0 C--O 1.245 0.835 1 O-C-N 131.006 5.191 . . . . 46.97 106.079 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -26.97 39.87 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 127.066 2.274 . . . . 74.61 110.993 -176.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -76.65 -36.89 57.1 Favored 'General case' 0 C--N 1.344 0.344 0 O-C-N 124.798 1.311 . . . . 62.77 109.397 -178.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 10.2 m -67.98 -41.17 82.73 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 127.109 2.756 . . . . 71.14 104.839 -179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . 0.68 ' O ' ' HB2' ' B' ' 77' ' ' HIS . 0.1 OUTLIER -58.46 -47.79 82.88 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 112.736 -2.029 . . . . 92.64 111.276 170.752 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.77 -40.06 32.33 Favored Glycine 0 C--N 1.314 -0.69 1 C-N-CA 113.149 -4.358 . . . . 53.13 112.196 -174.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LEU . . . . . 0.752 ' CD1' HG11 ' B' ' 133' ' ' VAL . 17.4 tp -55.7 -24.45 34.54 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 127.177 2.34 . . . . 84.31 111.83 -169.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -137.35 57.17 1.75 Allowed 'General case' 0 C--N 1.316 -0.889 0 O-C-N 126.043 2.089 . . . . 98.3 110.329 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.68 ' HB2' ' O ' ' B' ' 73' ' ' ASP . 0.6 OUTLIER -171.08 34.63 0.02 OUTLIER 'General case' 0 C--O 1.246 0.875 2 C-N-CA 133.178 4.591 . . . . 95.95 109.063 178.871 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.651 ' HB3' HG21 ' B' ' 1' ' ' VAL . 34.9 mt -71.71 -2.26 16.77 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 117.905 -1.518 . . . . 73.85 110.793 -168.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 49.6 t0 -86.62 -32.65 20.48 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 123.593 1.663 . . . . 95.26 109.171 -168.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -131.45 82.17 2.02 Favored 'General case' 0 C--N 1.285 -2.209 0 N-CA-C 103.601 -2.74 . . . . 100.0 103.601 166.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LEU . . . . . 0.581 HD22 ' CG1' ' B' ' 1' ' ' VAL . 0.0 OUTLIER -55.64 -25.37 38.74 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 127.891 3.244 . . . . 66.26 109.662 170.531 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . 4.0 mptt -90.4 -40.92 11.77 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 127.364 2.266 . . . . 95.2 110.458 -159.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.53 -51.72 54.14 Favored Glycine 0 C--N 1.314 -0.683 0 CA-C-N 110.947 -2.842 . . . . 66.32 108.211 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' THR . . . . . . . . . . . . . 87.4 m -57.95 -33.92 69.34 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 126.29 1.818 . . . . 71.23 110.693 -171.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -100.86 3.17 41.67 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 116.347 1.98 . . . . 69.8 116.347 -166.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.61 -40.45 87.57 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 125.451 2.548 . . . . 53.27 115.719 -167.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . 0.252 1.3 m -66.97 -37.58 84.51 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 111.618 -2.537 . . . . 70.21 110.109 -176.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 8.7 mt -75.62 -44.86 40.62 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.617 -2.083 . . . . 71.19 108.754 -176.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' SER . . . . . 0.416 ' OG ' ' HB2' ' B' ' 144' ' ' LYS . 2.9 t -54.68 -42.64 71.64 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.612 -1.255 . . . . 37.45 107.612 172.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -67.87 -41.61 82.58 Favored 'General case' 0 C--O 1.253 1.264 0 N-CA-C 106.5 -1.667 . . . . 100.0 106.5 -171.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tp -64.15 -36.89 85.51 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 125.359 2.504 . . . . 49.08 111.118 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HIS . . . . . 0.541 ' HA ' HD12 ' B' ' 96' ' ' LEU . 77.5 m80 -96.51 -17.97 20.14 Favored 'General case' 0 C--N 1.286 -2.18 0 C-N-CA 112.097 -3.841 . . . . 74.94 109.174 -171.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' CYS . . . . . 0.636 ' SG ' ' CE2' ' B' ' 145' ' ' TYR . 70.4 m -87.96 -72.24 0.54 Allowed 'General case' 0 C--N 1.312 -1.058 0 O-C-N 125.365 1.666 . . . . 90.38 109.018 -172.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -98.87 39.1 1.29 Allowed 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 114.768 -2.539 . . . . 82.8 109.618 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . 0.935 ' HE2' ' O ' ' B' ' 182' ' ' HOH . 16.1 mmtt -150.32 -38.1 0.14 Allowed 'General case' 0 C--N 1.321 -0.637 0 O-C-N 127.478 2.987 . . . . 100.0 114.544 -179.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . 0.541 HD12 ' HA ' ' B' ' 92' ' ' HIS . 13.9 mt -114.99 -7.6 12.53 Favored 'General case' 0 C--N 1.292 -1.921 0 C-N-CA 116.152 -2.219 . . . . 65.4 109.849 165.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HIS . . . . . 0.827 ' HD2' ' O ' ' B' ' 151' ' ' HOH . 97.1 m-70 57.21 50.63 11.4 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 113.112 0.782 . . . . 95.49 113.112 177.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . 0.628 HG22 ' CE2' ' B' ' 41' ' ' PHE . 43.0 t -94.22 120.47 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 103.489 -2.782 . . . . 38.4 103.489 -177.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . 0.446 ' HA ' ' HD2' ' B' ' 100' ' ' PRO . 12.2 t70 -63.65 123.05 80.02 Favored Pre-proline 0 C--N 1.298 -1.639 0 O-C-N 124.5 1.125 . . . . 44.76 108.96 175.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' PRO . . . . . 0.669 ' HD3' ' CE2' ' B' ' 145' ' ' TYR . 3.0 Cg_exo -40.71 -17.94 0.06 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.453 2 C-N-CA 131.312 8.008 . . . . 41.61 116.02 178.377 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . 0.623 ' O ' ' HG ' ' B' ' 105' ' ' LEU . 8.4 tp10 -77.91 -21.1 51.7 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 117.221 -1.792 . . . . 78.25 110.504 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASN . . . . . 0.77 HD21 ' HE1' ' B' ' 37' ' ' TRP . 29.3 m120 -75.68 -14.47 60.35 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 115.324 -2.551 . . . . 47.04 110.013 176.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.537 ' CD2' ' HA ' ' B' ' 100' ' ' PRO . 17.9 m-30 -72.34 -34.74 68.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.15 -1.841 . . . . 60.68 109.812 174.314 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 0.67 ' NH2' ' O ' ' B' ' 204' ' ' HOH . 29.9 mtt85 -73.01 -41.84 63.84 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 124.016 1.865 . . . . 98.47 111.949 171.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' B' ' 101' ' ' GLU . 17.6 mt -55.11 -54.55 41.75 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 113.153 -1.839 . . . . 28.96 114.498 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . 0.539 HD13 HD22 ' B' ' 31' ' ' LEU . 12.6 tp -51.16 -52.63 42.33 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 125.436 1.494 . . . . 41.7 109.586 173.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLY . . . . . . . . . . . . . . . -42.11 -57.39 3.61 Favored Glycine 0 N--CA 1.426 -1.992 0 O-C-N 127.75 3.156 . . . . 30.78 112.691 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -67.87 -28.44 67.53 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 115.252 1.575 . . . . 47.69 115.252 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 105' ' ' LEU . 2.6 m -77.4 -27.38 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 102.329 -3.212 . . . . 61.34 102.329 -179.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -34.42 77.26 Favored 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.888 -1.893 . . . . 57.83 105.888 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' VAL . . . . . . . . . . . . . 76.6 t -73.66 -32.82 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.686 0 C-N-CA 114.138 -3.025 . . . . 35.22 109.324 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' CYS . . . . . . . . . . . . . 57.7 m -60.01 -46.68 88.69 Favored 'General case' 0 C--N 1.29 -2.016 0 C-N-CA 117.611 -1.636 . . . . 42.76 112.565 173.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.847 HG21 ' HB2' ' B' ' 27' ' ' ALA . 70.3 t -61.43 -41.12 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 125.772 1.629 . . . . 68.82 111.285 -175.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 96.1 mt -68.51 -47.95 65.65 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 127.302 2.877 . . . . 32.47 109.517 176.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -54.05 -38.23 65.02 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 115.361 -2.536 . . . . 45.78 114.352 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -70.66 -23.82 62.58 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 107.663 -1.236 . . . . 52.69 107.663 -177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HIS . . . . . . . . . . . . . 15.5 m170 -94.5 -27.39 16.0 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 116.012 -2.275 . . . . 100.0 109.449 -168.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -107.15 -10.47 15.86 Favored 'General case' 0 C--N 1.267 -2.994 0 CA-C-O 123.712 1.72 . . . . 72.53 111.408 -172.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLY . . . . . . . . . . . . . . . 42.47 -113.4 0.59 Allowed Glycine 0 N--CA 1.435 -1.37 0 CA-C-N 114.564 -1.198 . . . . 33.85 115.949 -169.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -70.28 -19.39 63.11 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 106.456 -1.683 . . . . 91.22 106.456 -166.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -74.02 -8.28 55.56 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 124.873 2.273 . . . . 100.0 108.35 -174.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' PHE . . . . . 0.601 ' HD1' HD11 ' B' ' 14' ' ' LEU . 14.3 t80 -100.47 76.32 1.84 Allowed 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 111.618 -2.537 . . . . 57.57 109.415 175.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' THR . . . . . 0.778 ' N ' ' O ' ' B' ' 207' ' ' HOH . 27.7 p -77.27 163.35 65.14 Favored Pre-proline 0 N--CA 1.435 -1.2 0 N-CA-C 106.737 -1.579 . . . . 40.86 106.737 -175.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -55.42 -42.17 70.85 Favored 'Trans proline' 0 C--N 1.293 -2.391 0 C-N-CA 122.698 2.265 . . . . 44.34 113.111 -177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_exo -63.22 -25.33 72.31 Favored 'Trans proline' 0 N--CA 1.504 2.13 0 C-N-CA 124.421 3.414 . . . . 61.66 112.741 175.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' VAL . . . . . 1.293 ' HB ' ' O ' ' B' ' 207' ' ' HOH . 75.3 t -88.04 -32.77 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 113.495 -3.282 . . . . 44.56 105.674 -176.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLN . . . . . 0.48 ' OE1' ' HD3' ' A' ' 31' ' ' ARG . 19.8 tt0 -62.61 -44.71 95.61 Favored 'General case' 0 C--N 1.268 -2.953 0 C-N-CA 115.663 -2.415 . . . . 50.99 112.592 175.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' B' ' 132' ' ' LYS . . . -53.44 -36.37 61.5 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.496 -1.684 . . . . 50.73 111.046 173.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ALA . . . . . 0.563 ' O ' HG23 ' B' ' 133' ' ' VAL . . . -72.81 -37.09 67.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 122.339 1.066 . . . . 54.83 110.448 -178.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -75.49 -27.55 58.85 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 112.762 -2.017 . . . . 56.11 109.705 -172.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.623 ' HG3' ' HB3' ' A' ' 35' ' ' SER . 13.7 mm100 -70.63 -34.84 72.53 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 126.609 2.443 . . . . 34.86 107.494 -175.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' B' ' 128' ' ' ALA . 72.2 mttt -69.05 -28.79 66.86 Favored 'General case' 0 C--N 1.273 -2.734 0 C-N-CA 115.519 -2.473 . . . . 54.96 110.706 -177.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' VAL . . . . . 0.752 HG11 ' CD1' ' B' ' 75' ' ' LEU . 91.8 t -82.8 -42.54 18.19 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.949 0 O-C-N 127.087 2.742 . . . . 44.81 108.991 -167.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -65.46 -37.33 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 127.874 3.233 . . . . 56.52 106.462 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ALA . . . . . 0.414 ' O ' ' ND2' ' B' ' 139' ' ' ASN . . . -57.93 -39.93 79.2 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 124.896 1.372 . . . . 33.64 111.863 171.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.57 -35.87 39.92 Favored Glycine 0 N--CA 1.418 -2.532 1 N-CA-C 101.382 -4.687 . . . . 32.96 101.382 -166.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' VAL . . . . . . . . . . . . 0.251 78.3 t -69.31 -44.19 80.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 109.985 -3.107 . . . . 53.08 109.524 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ALA . . . . . . . . . . . . . . . -63.47 -31.96 73.27 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 125.779 1.924 . . . . 41.99 108.857 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ASN . . . . . 0.414 ' ND2' ' O ' ' B' ' 135' ' ' ALA . 70.5 m-20 -76.65 -24.48 53.29 Favored 'General case' 0 C--N 1.279 -2.484 0 O-C-N 120.199 -1.563 . . . . 80.98 111.643 -178.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . 0.539 ' O ' ' O ' ' B' ' 210' ' ' HOH . . . -79.68 -41.02 27.74 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 123.358 1.551 . . . . 64.94 110.258 -175.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' LEU . . . . . . . . . . . . 0.333 6.1 mt -68.8 -32.19 71.74 Favored 'General case' 0 C--N 1.275 -2.643 0 CA-C-N 114.523 -1.217 . . . . 41.8 110.496 177.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.93 14.77 9.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 114.62 -2.832 . . . . 35.02 109.267 -171.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -84.0 -8.63 59.1 Favored 'General case' 0 C--N 1.285 -2.229 0 C-N-CA 115.608 -2.437 . . . . 84.08 113.682 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LYS . . . . . 0.788 ' HB2' ' O ' ' B' ' 181' ' ' HOH . 0.0 OUTLIER -98.38 27.64 4.6 Favored 'General case' 0 C--O 1.232 0.153 0 C-N-CA 114.134 -3.026 . . . . 98.22 111.481 178.327 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' TYR . . . . . 0.669 ' CE2' ' HD3' ' B' ' 100' ' ' PRO . 3.9 m-85 -102.5 -0.31 32.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 125.18 1.392 . . . . 100.0 109.075 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HIS . . . . . . . . . . . . 0.276 1.0 OUTLIER . . . . . 0 C--O 1.258 1.54 0 C-N-CA 131.036 3.734 . . . . 100.0 112.949 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HEM . . . . . 0.522 HAD1 ' O ' ' A' ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' HEM . . . . . 0.622 HBD1 ' HHA' ' B' ' 147' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' OXY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.516 ' O ' ' HD2' ' A' ' 7' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . 0.823 ' O ' ' HD2' ' A' ' 103' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . 1.252 ' O ' ' HB3' ' A' ' 37' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . 0.656 ' O ' ' OE2' ' A' ' 23' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . 1.124 ' O ' ' HB3' ' A' ' 24' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . 0.857 ' O ' ' CD1' ' A' ' 109' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . 0.919 ' O ' ' OE1' ' A' ' 30' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . 0.864 ' O ' ' OD1' ' A' ' 64' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . 0.522 ' O ' HAD1 ' A' ' 143' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' HOH . . . . . 0.827 ' O ' ' HD2' ' B' ' 97' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' HOH . . . . . 0.478 ' O ' ' HE2' ' B' ' 17' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' HOH . . . . . 0.561 ' O ' ' CG ' ' B' ' 22' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' HOH . . . . . 0.681 ' O ' ' CD ' ' B' ' 43' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' HOH . . . . . 0.788 ' O ' ' HB2' ' B' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' HOH . . . . . 0.935 ' O ' ' HE2' ' B' ' 95' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' HOH . . . . . 0.74 ' O ' HD13 ' B' ' 68' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . 0.6 ' O ' ' HG3' ' B' ' 144' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . 0.67 ' O ' ' NH2' ' B' ' 104' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . 1.293 ' O ' ' HB ' ' B' ' 126' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . 0.539 ' O ' ' O ' ' B' ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_