data_1hxf_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 1hxf _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 ' L' L ' 1' A ASP . . . . . . . . . . . . . 37.0 t0 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 100.81 -3.774 . . . . 50.0 100.81 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 5.1 p -52.25 145.0 11.57 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 126.475 2.359 . . . . 24.26 112.966 -172.501 81.869 65.075 106.673 109.124 2.008 97.57 -66.092 -52.206 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.66 7.69 29.38 Favored Glycine 0 C--O 1.255 1.468 0 CA-C-O 114.793 -3.226 . . . . 16.5 117.39 173.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 75.8 mt -102.29 107.8 18.96 Favored 'General case' 0 C--N 1.322 -0.617 1 CA-C-O 111.172 -4.251 . . . . 17.27 103.47 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -74.4 139.17 74.85 Favored Pre-proline 0 C--O 1.245 0.857 1 O-C-N 129.947 4.529 . . . . 16.54 111.034 -178.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . 0.305 12.3 Cg_exo -64.29 -37.55 39.81 Favored 'Trans proline' 0 C--O 1.254 1.319 0 O-C-N 118.842 -1.188 . . . . 23.3 113.634 -178.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.59 -2.25 54.4 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 118.472 -2.642 . . . . 20.37 111.604 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -123.46 -88.03 0.62 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.679 1.581 . . . . 19.27 107.412 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -51.2 -54.22 27.66 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-O 117.745 -1.121 . . . . 20.24 113.037 -177.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 25.6 mmtp -51.18 -29.0 12.6 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 126.034 1.733 . . . . 36.45 115.235 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -113.1 5.71 17.24 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.735 -1.209 . . . . 31.18 107.735 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t 58.17 46.08 16.5 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 113.839 -1.528 . . . . 28.62 113.4 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 51.5 mt -114.08 146.16 40.62 Favored 'General case' 0 C--O 1.254 1.316 0 N-CA-C 105.848 -1.908 . . . . 25.64 105.848 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -100.93 146.59 27.17 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-O 114.369 -2.729 . . . . 41.68 107.531 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -83.94 167.15 17.22 Favored 'General case' 0 C--O 1.25 1.091 1 CA-C-O 128.995 4.236 . . . . 20.5 104.514 173.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER -67.49 -12.23 59.82 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-N 109.738 -3.392 . . . . 49.08 116.689 -171.312 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 54.1 p -135.75 0.18 2.66 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 122.922 2.601 . . . . 24.4 110.778 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 11.0 pt-20 -49.45 -43.33 44.79 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 128.633 3.708 . . . . 20.88 109.403 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . 0.716 ' NH2' ' O ' ' L' ' 531' ' ' HOH . 0.0 OUTLIER -40.6 -45.69 2.38 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 123.433 2.833 . . . . 50.0 113.548 178.43 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 15.1 tt0 -60.07 -39.51 86.3 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 128.172 2.589 . . . . 37.64 108.915 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . . . . . . . . . 3.9 mp -59.5 -57.45 12.9 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 119.765 -1.834 . . . . 22.29 112.16 171.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . . 1.8 mm? -64.52 -33.66 76.42 Favored 'General case' 0 C--N 1.316 -0.85 1 CA-C-O 128.763 4.125 . . . . 28.57 111.564 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . 0.498 ' OE2' ' CZ ' ' L' ' 14' D ARG . 95.8 mt-10 -68.13 -25.09 65.12 Favored 'General case' 0 C--N 1.305 -1.344 1 O-C-N 115.681 -4.387 . . . . 35.24 105.509 179.466 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . . . . . . . . . 76.0 p -85.47 -12.83 50.91 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 114.945 -2.455 . . . . 29.54 115.699 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . . . . . . . . . 7.1 m-85 -91.64 48.72 1.49 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 102.336 -3.209 . . . . 33.21 102.336 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . . . . . . . . 0.343 0.2 OUTLIER . . . . . 0 C--O 1.259 1.576 1 CA-C-N 107.899 -4.228 . . . . 48.91 107.523 -171.968 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 10.5 mm . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 102.315 -3.217 . . . . 20.74 102.315 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . 0.445 ' O ' ' CA ' ' H' ' 188' ' ' GLY . 73.8 t -109.2 121.29 62.02 Favored 'Isoleucine or valine' 0 C--O 1.265 1.921 0 C-N-CA 130.505 3.522 . . . . 28.27 106.406 176.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 72.62 32.89 1.45 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.719 1.887 . . . . 45.72 114.157 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.55 -175.06 29.76 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 125.697 2.832 . . . . 30.8 109.175 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 56.3 p -129.52 166.89 18.75 Favored 'General case' 0 C--O 1.254 1.323 0 N-CA-C 103.027 -2.953 . . . . 36.88 103.027 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -64.84 133.1 51.21 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 128.35 3.531 . . . . 35.08 109.134 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.97 152.86 43.96 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 105.847 -1.908 . . . . 26.85 105.847 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -78.44 165.28 23.96 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 126.702 2.001 . . . . 30.92 108.318 170.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 mm -68.94 147.61 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 119.256 -2.152 . . . . 24.61 107.007 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 52.59 22.19 10.81 Favored Glycine 0 N--CA 1.439 -1.119 0 C-N-CA 128.217 2.818 . . . . 19.33 117.393 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 6.2 ttt -70.7 -33.31 70.76 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 122.054 2.927 . . . . 20.5 114.745 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.325 0.6 OUTLIER -133.75 67.46 74.76 Favored Pre-proline 0 C--N 1.297 -1.705 0 C-N-CA 129.558 3.143 . . . . 24.26 112.225 -178.768 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -70.98 -5.51 17.12 Favored 'Trans proline' 0 C--N 1.284 -2.832 0 O-C-N 123.781 1.411 . . . . 16.92 113.344 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.8 p90 -94.11 -4.72 48.75 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 116.974 -1.489 . . . . 13.49 109.257 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -68.72 128.32 36.24 Favored 'General case' 0 C--O 1.263 1.789 0 CA-C-N 121.066 1.757 . . . . 21.32 110.443 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 69.4 t -116.93 148.17 19.83 Favored 'Isoleucine or valine' 0 C--O 1.252 1.23 0 O-C-N 121.801 -0.562 . . . . 18.58 110.276 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 42.8 ttm -106.48 126.33 52.13 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 106.419 -1.697 . . . . 23.18 106.419 176.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.63 113.2 21.1 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 106.874 -1.528 . . . . 28.6 106.874 172.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -125.32 133.68 52.51 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-O 127.305 3.431 . . . . 28.74 110.921 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' H' ' 486' ' ' HOH . 25.9 ttt180 -77.23 122.77 25.52 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 109.435 -3.53 . . . . 38.7 111.316 175.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . 0.436 ' CE ' ' O ' ' H' ' 513' ' ' HOH . 12.1 mttt -57.9 -52.2 66.46 Favored 'General case' 0 C--O 1.258 1.536 0 CA-C-N 113.529 -1.669 . . . . 39.99 112.625 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -152.34 117.79 3.02 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 124.911 1.382 . . . . 47.76 113.868 -179.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -70.34 133.19 25.59 Favored 'Cis proline' 0 C--N 1.32 -0.97 0 N-CA-C 106.151 -2.288 . . . . 42.39 106.151 -1.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -52.37 116.42 2.24 Favored 'General case' 0 C--N 1.29 -2.006 0 C-N-CA 130.46 3.504 . . . . 50.0 107.27 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -166.61 154.48 9.89 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 126.981 2.676 . . . . 47.62 112.019 -178.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 tp -73.48 120.31 18.91 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.14 -1.8 . . . . 34.91 106.14 -178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.83 -56.33 3.34 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 127.833 3.208 . . . . 28.34 109.994 175.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.288 4.6 m -164.59 -177.16 4.66 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 118.848 -2.407 . . . . 21.24 105.946 -175.174 -86.582 -164.453 -96.651 104.828 2.0 108.431 -83.191 -75.591 2 2 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -101.26 175.05 25.61 Favored Glycine 0 C--O 1.27 2.383 0 N-CA-C 105.127 -3.189 . . . . 17.37 105.127 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -165.42 -179.06 5.29 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 101.358 -3.571 . . . . 11.15 101.358 -179.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 32.4 p -141.39 147.37 37.9 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 126.311 2.257 . . . . 15.02 110.375 176.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . 0.65 ' CD2' ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -85.67 128.01 34.66 Favored 'General case' 0 C--O 1.248 0.988 0 N-CA-C 105.997 -1.853 . . . . 19.34 105.997 179.249 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.18 -14.85 10.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 125.397 1.479 . . . . 18.16 112.297 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . 0.65 ' O ' ' CD2' ' H' ' 46' ' ' LEU . 58.4 p -166.34 176.09 7.74 Favored 'General case' 0 C--O 1.273 2.316 0 CA-C-O 116.549 -1.691 . . . . 28.02 108.004 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.5 -15.37 49.83 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 113.93 -2.938 . . . . 35.92 115.701 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.756 ' NE ' ' NZ ' ' H' ' 107' ' ' LYS 0.283 0.0 OUTLIER -124.2 -8.69 7.62 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 114.697 -2.573 . . . . 49.01 112.885 -178.057 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -119.79 130.37 54.9 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 120.42 1.464 . . . . 24.46 113.54 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 66.1 t -120.59 139.38 48.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 115.321 -2.276 . . . . 22.41 109.072 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 27.3 tp -115.52 137.87 51.62 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 125.025 1.453 . . . . 20.79 112.847 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 6.0 t -155.98 175.86 13.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 124.797 1.239 . . . . 18.32 111.939 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.93 136.45 37.26 Favored 'General case' 0 C--O 1.266 1.951 0 N-CA-C 107.71 -1.218 . . . . 16.88 107.71 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -29.26 69.76 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 115.12 -2.371 . . . . 16.83 112.681 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . 0.49 ' NE2' ' OG ' ' H' ' 195' ' ' SER . 32.2 p-80 -72.75 -9.21 58.38 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 120.489 1.495 . . . . 24.33 111.152 -172.457 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 55.0 m -73.74 -30.9 63.07 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 126.148 2.155 . . . . 24.17 109.791 175.812 -75.591 -83.191 -96.651 108.431 2.0 104.828 -164.453 -86.582 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -98.49 -46.16 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 O-C-N 120.899 -1.125 . . . . 25.24 111.776 -176.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 51.7 tp -128.08 110.3 12.35 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.141 1.776 . . . . 27.73 113.734 -175.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . 0.417 ' N ' ' O ' ' H' ' 60' F LYS . 39.3 t80 -149.23 83.2 6.68 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 113.989 -1.46 . . . . 27.95 110.222 174.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . . . . . . . . 0.287 23.3 Cg_exo -50.67 -34.41 43.55 Favored 'Trans proline' 0 CA--C 1.495 -1.459 0 C-N-CA 124.456 3.437 . . . . 28.97 117.726 -178.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . . . . . . . . . 4.5 Cg_exo -64.0 -14.59 44.31 Favored 'Trans proline' 0 C--N 1.305 -1.762 0 CA-C-N 122.96 2.093 . . . . 32.2 112.514 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 45.8 m0 -121.34 18.31 11.43 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.071 -1.825 . . . . 42.33 106.071 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . . 11.9 m-20 54.63 35.85 24.67 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 114.352 -2.939 . . . . 45.89 113.111 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . 0.698 ' CE ' ' O ' ' H' ' 527' ' ' HOH . 30.7 ttmt -103.39 113.71 27.42 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 123.235 1.493 . . . . 33.91 107.94 175.594 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . . . . . . . . . 59.1 t-20 -151.37 82.02 1.3 Allowed 'General case' 0 C--O 1.252 1.2 0 CA-C-N 112.76 -2.018 . . . . 39.76 109.653 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 25.6 m-85 -81.1 132.44 35.36 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.473 1.509 . . . . 33.17 114.356 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . 0.279 0.8 OUTLIER -98.07 165.68 11.79 Favored 'General case' 0 C--O 1.248 0.997 0 CA-C-O 126.15 2.881 . . . . 35.55 111.888 174.134 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . 0.467 ' OE1' ' CA ' ' H' ' 87' ' ' LYS . 0.2 OUTLIER -50.3 -48.8 54.93 Favored 'General case' 0 C--O 1.268 2.07 1 O-C-N 115.497 -4.502 . . . . 47.58 115.323 175.854 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -59.22 -24.27 63.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 113.796 -1.547 . . . . 50.0 113.535 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -77.91 -12.93 60.02 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-O 112.2 -3.762 . . . . 44.79 114.373 -175.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.45 169.27 18.08 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 128.353 3.533 . . . . 30.41 115.734 -173.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.65 150.28 46.24 Favored 'General case' 0 C--N 1.301 -1.505 1 CA-C-N 107.881 -4.236 . . . . 26.67 109.746 172.141 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.331 0.9 OUTLIER -114.71 121.46 66.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 CA-C-O 125.853 2.739 . . . . 25.22 107.954 171.387 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -111.38 112.67 24.59 Favored 'General case' 0 C--O 1.252 1.2 0 O-C-N 116.856 -3.652 . . . . 21.83 112.681 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.2 137.6 41.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 127.426 2.29 . . . . 22.03 115.101 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.55 48.39 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 124.957 1.265 . . . . 17.81 114.141 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . 0.535 ' NZ ' ' OE2' ' H' ' 80' ' ' GLU . 19.3 mtpp -81.78 159.18 23.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.138 0.97 . . . . 19.66 113.551 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 52.7 t60 -135.2 -57.46 0.8 Allowed 'General case' 0 C--O 1.259 1.58 0 C-N-CA 128.992 2.917 . . . . 24.07 105.017 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 33.1 t -69.92 136.43 50.58 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 111.014 -2.812 . . . . 24.04 108.53 177.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 52.0 ttp85 -69.72 -47.68 62.24 Favored 'General case' 0 C--O 1.258 1.531 0 C-N-CA 123.76 0.824 . . . . 35.97 111.734 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 20.2 p -109.08 -13.86 14.63 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 119.931 3.308 . . . . 28.74 119.931 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 0.76 ' NH2' ' O ' ' H' ' 469' ' ' HOH . 0.1 OUTLIER -75.97 157.66 32.86 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 121.202 1.819 . . . . 44.15 113.476 173.139 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -97.07 98.61 10.2 Favored 'General case' 0 C--O 1.258 1.545 0 N-CA-C 103.234 -2.876 . . . . 34.22 103.234 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -82.02 82.47 7.6 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 127.435 3.493 . . . . 27.14 112.521 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . 0.568 ' O ' ' O ' ' H' ' 404' ' ' HOH . 18.0 ttp85 -53.94 126.71 23.44 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 128.908 2.883 . . . . 27.73 107.869 -179.025 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 8.2 m120 75.83 -12.94 0.93 Allowed 'General case' 0 C--O 1.255 1.343 0 CA-C-N 109.823 -3.353 . . . . 31.93 112.62 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.81 -56.39 5.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 118.945 -2.347 . . . . 23.68 111.588 -178.717 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . 0.535 ' OE2' ' NZ ' ' H' ' 70' ' ' LYS . 4.4 pt-20 -82.8 147.73 28.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 O-C-N 127.106 2.754 . . . . 24.47 114.7 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -120.29 129.2 53.91 Favored 'General case' 0 C--N 1.303 -1.413 0 C-N-CA 128.676 2.79 . . . . 42.46 105.085 175.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 84.2 mt -110.15 125.69 67.38 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 CA-C-O 113.066 -3.35 . . . . 28.18 107.269 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -131.06 173.87 10.58 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 125.468 2.556 . . . . 37.31 110.09 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -114.61 142.56 46.28 Favored 'General case' 0 C--N 1.314 -0.951 1 CA-C-N 107.181 -4.554 . . . . 40.75 105.663 -177.403 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . 0.519 ' CD1' ' CE ' ' H' ' 106' ' ' MET . 22.1 mt -88.42 139.52 30.41 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 130.89 5.119 . . . . 34.69 109.216 -179.219 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . 0.453 ' OE1' ' NH2' ' H' ' 50' ' ' ARG . 30.2 tt0 -94.68 -35.75 12.04 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.94 -2.245 . . . . 45.85 104.94 178.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . 0.467 ' CA ' ' OE1' ' H' ' 61' ' ' GLU . 2.2 tmtt? -163.85 145.87 9.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 116.053 -2.259 . . . . 41.41 112.076 -176.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 62.1 mt -114.83 130.81 68.65 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 O-C-N 127.601 3.063 . . . . 29.59 111.809 177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -122.69 127.53 49.39 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 116.188 -1.863 . . . . 39.58 109.888 174.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.57 150.56 8.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 C-N-CA 126.497 1.919 . . . . 23.49 109.188 177.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -64.42 130.57 94.73 Favored Pre-proline 0 C--O 1.254 1.298 0 CA-C-N 122.419 2.372 . . . . 21.31 107.95 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -55.55 -30.93 76.59 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 122.213 1.942 . . . . 27.37 111.71 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -109.36 26.82 10.19 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-N 121.306 1.866 . . . . 45.32 114.019 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . 0.286 2.4 t80 -53.06 137.6 32.94 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 114.81 -2.519 . . . . 22.4 108.387 174.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -113.44 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.38 1 CA-C-N 126.966 4.439 . . . . 28.82 110.64 -178.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -86.32 -13.61 46.06 Favored 'General case' 0 C--O 1.26 1.645 0 CA-C-O 115.817 -2.04 . . . . 28.47 108.512 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 43.8 mtt-85 -77.96 -40.5 39.17 Favored 'General case' 0 C--O 1.241 0.614 0 O-C-N 126.283 2.239 . . . . 38.01 113.698 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . . . . . . . . . 8.1 tt0 -106.25 -62.28 1.4 Allowed 'General case' 0 C--O 1.251 1.134 0 CA-C-O 113.209 -3.282 . . . . 42.72 113.322 -176.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.445 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 33.2 p30 -138.04 12.77 2.87 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 115.42 -2.229 . . . . 27.22 114.521 -174.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 10.6 mt 65.65 37.48 5.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 123.902 3.046 . . . . 29.74 112.564 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -72.22 136.71 46.45 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 112.47 -3.633 . . . . 25.36 103.27 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . 0.545 ' NH2' ' O ' ' H' ' 499' ' ' HOH . 70.1 mtt85 66.25 35.95 5.69 Favored 'General case' 0 C--N 1.314 -0.939 1 O-C-N 131.662 5.601 . . . . 27.82 112.873 -179.246 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . 0.417 ' OD2' ' ND1' ' H' ' 57' ' ' HIS . 48.0 t0 -67.61 82.99 0.17 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 116.591 -1.671 . . . . 13.38 107.13 -177.787 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 7.1 tt -150.44 147.56 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 CA-C-O 116.088 -1.911 . . . . 15.98 108.675 -178.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -154.77 146.11 22.97 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 108.11 -1.07 . . . . 19.5 108.11 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.47 145.53 34.52 Favored 'General case' 0 C--O 1.258 1.522 0 C-N-CA 125.401 1.48 . . . . 24.96 108.075 173.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . 0.519 ' CE ' ' CD1' ' H' ' 85' ' ' LEU . 39.2 mtp -123.14 126.45 47.04 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 114.756 -2.545 . . . . 32.02 106.582 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.756 ' NZ ' ' NE ' ' H' ' 50' ' ' ARG . 41.5 tttp -94.58 123.27 37.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 113.069 -3.348 . . . . 41.0 106.105 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.72 144.67 37.07 Favored 'General case' 0 N--CA 1.5 2.057 1 O-C-N 130.758 5.036 . . . . 28.05 108.875 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 3.5 tptm -60.9 -25.73 66.94 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 121.205 1.82 . . . . 48.37 107.719 178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -158.18 149.44 16.61 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 119.575 -1.953 . . . . 50.0 109.648 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.21 146.54 95.92 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 O-C-N 126.327 2.751 . . . . 32.93 110.069 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . 0.306 4.4 p -99.13 146.52 8.34 Favored 'Isoleucine or valine' 0 C--O 1.252 1.217 1 CA-C-N 106.798 -4.728 . . . . 29.84 105.416 178.682 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.02 134.65 36.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 111.343 -2.662 . . . . 25.94 108.39 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . 0.426 ' N ' ' CD1' ' H' ' 114' ' ' PHE . 22.2 m-30 -64.17 156.96 26.9 Favored 'General case' 0 C--O 1.254 1.338 0 C-N-CA 130.042 3.337 . . . . 22.88 107.438 176.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 4.3 p -170.4 -169.04 0.77 Allowed 'General case' 0 N--CA 1.487 1.379 1 O-C-N 130.425 4.828 . . . . 22.57 104.512 -178.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.01 -29.87 70.99 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-O 115.379 -2.248 . . . . 28.95 110.826 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -111.05 -4.3 15.15 Favored 'General case' 0 C--O 1.257 1.488 0 O-C-N 128.383 3.552 . . . . 27.81 115.858 -170.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 52.2 mt -131.62 113.91 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 1 O-C-N 131.113 5.258 . . . . 18.24 110.688 -176.515 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -169.16 139.71 1.86 Allowed Pre-proline 0 C--O 1.258 1.523 1 O-C-N 130.606 4.942 . . . . 21.4 109.568 -174.015 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_endo -82.53 158.1 16.7 Favored 'Trans proline' 0 C--O 1.258 1.504 0 C-N-CA 122.91 2.406 . . . . 15.57 114.788 -175.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 p -98.35 157.77 3.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-N 109.29 -3.596 . . . . 14.88 105.309 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 38.7 m -92.44 153.07 19.35 Favored 'General case' 0 C--O 1.205 -1.277 0 O-C-N 125.431 1.707 . . . . 15.07 108.563 179.015 -52.206 -66.092 106.673 97.57 2.008 109.124 65.075 81.869 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 52.9 mt -102.75 133.56 20.36 Favored Pre-proline 0 C--N 1.287 -2.118 0 N-CA-C 102.222 -3.251 . . . . 15.09 102.222 175.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -67.48 151.87 79.4 Favored 'Trans proline' 0 C--O 1.243 0.744 0 O-C-N 127.976 3.619 . . . . 21.0 106.337 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -111.81 157.27 20.76 Favored 'General case' 0 C--O 1.26 1.652 0 N-CA-C 102.072 -3.307 . . . . 37.65 102.072 172.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' H' ' 466' ' ' HOH . 29.2 ttt180 -38.87 -37.85 0.38 Allowed 'General case' 0 C--O 1.246 0.893 0 N-CA-C 119.887 3.291 . . . . 50.0 119.887 -178.499 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . 0.26 0.9 OUTLIER -82.08 -27.55 32.84 Favored 'General case' 0 C--O 1.276 2.455 0 C-N-CA 117.871 -1.532 . . . . 45.72 111.992 -178.103 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 31.1 m -65.1 -52.83 53.17 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.976 -1.49 . . . . 33.53 106.976 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.61 86.72 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.719 0.771 . . . . 25.39 109.338 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -54.06 -47.8 71.28 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 116.003 -1.951 . . . . 26.19 109.701 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.7 OUTLIER -74.8 -36.88 62.47 Favored 'General case' 0 C--O 1.255 1.345 1 CA-C-O 111.678 -4.01 . . . . 32.6 117.548 -177.918 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 29.9 mt -95.94 -28.67 14.56 Favored 'General case' 0 C--O 1.259 1.57 0 O-C-N 126.077 2.111 . . . . 25.07 115.457 -175.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.49 78.49 1.05 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 115.805 -2.358 . . . . 22.51 108.952 179.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -129.01 140.56 51.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 123.432 1.586 . . . . 45.04 113.3 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.87 134.93 55.78 Favored 'General case' 0 C--O 1.253 1.266 1 CA-C-O 106.798 -6.334 . . . . 22.54 102.403 -176.988 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.72 -44.9 1.38 Allowed Glycine 0 CA--C 1.54 1.628 1 O-C-N 136.387 8.555 . . . . 19.63 115.692 -177.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -63.67 129.69 41.2 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.168 1.387 . . . . 24.75 107.963 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 59.2 mttt -84.65 144.61 28.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.682 -3.532 . . . . 20.73 117.056 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.44 179.63 16.21 Favored Glycine 0 CA--C 1.549 2.199 1 O-C-N 129.236 4.085 . . . . 10.01 104.785 174.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -127.41 134.8 49.86 Favored 'General case' 0 C--O 1.268 2.031 0 C-N-CA 125.597 1.559 . . . . 16.32 111.297 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 21.9 t -118.95 139.88 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 126.437 1.895 . . . . 16.8 106.866 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 16.9 p -133.84 153.28 51.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 113.688 -3.053 . . . . 15.37 109.24 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.15 37.37 Favored Glycine 0 N--CA 1.488 2.122 0 C-N-CA 115.087 -3.435 . . . . 16.98 107.325 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -108.48 22.77 15.48 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 127.157 2.328 . . . . 25.82 108.212 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -78.21 -177.59 48.25 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 125.553 2.752 . . . . 26.98 110.11 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . 0.592 ' ND2' ' O ' ' H' ' 480' ' ' HOH . 59.8 m-20 -50.01 138.08 16.15 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 110.507 -2.846 . . . . 36.05 109.397 179.018 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 96.5 mt -89.04 -6.88 56.84 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 108.41 -3.996 . . . . 36.28 110.338 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -150.74 140.39 21.66 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 127.785 3.178 . . . . 50.0 111.275 -171.597 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.779 ' N ' ' O ' ' H' ' 509' ' ' HOH 0.26 27.6 tt0 . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 125.578 2.608 . . . . 48.6 107.881 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 N-CA-C 116.561 1.385 . . . . 43.45 116.561 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -126.25 122.16 24.0 Favored Pre-proline 0 C--N 1.309 -1.187 0 C-N-CA 128.003 2.521 . . . . 50.0 106.738 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.08 163.55 31.0 Favored 'Trans proline' 0 C--N 1.322 -0.848 0 O-C-N 125.611 2.374 . . . . 36.1 108.5 -174.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.74 -25.87 15.91 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 114.016 -3.074 . . . . 38.53 106.066 173.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . 0.372 0.4 OUTLIER -135.67 156.68 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 115.0 -2.428 . . . . 25.88 110.591 -175.65 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.1 tp -45.83 123.11 4.17 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 130.473 3.509 . . . . 20.7 107.353 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . 0.422 ' C ' ' CG2' ' H' ' 157' ' ' VAL . 13.2 mm100 -102.59 166.56 10.45 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.476 1.11 . . . . 25.85 111.49 -177.317 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . 0.422 ' CG2' ' C ' ' H' ' 156' ' ' GLN . 12.5 t -144.17 155.27 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 114.73 -2.557 . . . . 24.15 111.451 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -153.46 142.86 14.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-O 113.37 -3.205 . . . . 19.19 109.185 171.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -99.65 132.77 44.77 Favored 'General case' 0 C--O 1.27 2.152 0 C-N-CA 128.833 2.853 . . . . 20.4 106.456 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.7 mt -142.05 147.31 43.86 Favored Pre-proline 0 C--N 1.304 -1.37 0 O-C-N 124.328 1.018 . . . . 22.42 109.663 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -79.09 138.69 14.55 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 CA-C-O 113.106 -2.956 . . . . 18.22 115.943 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 3.6 mt -69.91 133.72 31.37 Favored 'Isoleucine or valine' 0 C--O 1.287 3.039 0 CA-C-N 121.202 1.819 . . . . 20.82 110.761 168.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 48.5 t -103.3 152.32 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.751 0 C-N-CA 118.413 -1.315 . . . . 18.41 109.288 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -60.12 131.69 51.61 Favored 'General case' 0 C--N 1.293 -1.866 1 C-N-CA 131.846 4.058 . . . . 44.27 107.987 -179.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.597 ' CD ' ' O ' ' H' ' 422' ' ' HOH . 6.0 ttt85 -35.95 -50.96 1.61 Allowed Pre-proline 0 C--N 1.301 -1.507 0 C-N-CA 127.404 2.281 . . . . 48.84 116.911 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -64.8 -49.04 3.32 Favored 'Trans proline' 0 C--O 1.259 1.53 0 C-N-CA 124.701 3.601 . . . . 27.58 112.196 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 19.2 t -52.2 -40.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 C-N-CA 119.387 -0.925 . . . . 26.06 108.67 174.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 59.5 m -61.14 -51.72 67.9 Favored 'General case' 0 C--O 1.269 2.1 0 O-C-N 121.135 -0.978 . . . . 23.75 108.957 178.616 -55.271 -75.327 -82.553 102.021 2.008 106.2 -86.306 86.989 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . 0.865 ' NZ ' ' O ' ' H' ' 422' ' ' HOH . 3.4 mtpp -55.54 -42.82 75.14 Favored 'General case' 0 C--O 1.26 1.65 0 CA-C-O 125.899 2.761 . . . . 37.53 118.074 -178.001 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -69.03 -12.21 61.48 Favored 'General case' 0 C--N 1.281 -2.371 1 C-N-CA 134.607 5.163 . . . . 25.28 114.312 179.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 87.2 p -93.12 -15.77 25.67 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 113.891 -2.957 . . . . 25.86 108.472 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 7.0 t -139.84 175.65 9.4 Favored 'General case' 0 C--O 1.25 1.123 1 O-C-N 130.529 4.893 . . . . 27.67 115.418 -177.264 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -102.13 -8.63 21.22 Favored 'General case' 0 C--O 1.25 1.105 0 O-C-N 119.047 -2.283 . . . . 35.56 108.98 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 87.8 mt -76.64 135.56 26.46 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 O-C-N 128.092 3.37 . . . . 33.81 111.745 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.445 ' O ' ' ND2' ' H' ' 98' ' ' ASN . 64.8 ttp85 -70.0 103.59 2.31 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-N 112.885 -1.961 . . . . 41.96 111.558 177.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . 0.509 ' CD1' ' CE2' ' H' ' 227' ' ' PHE . 4.4 mm -81.18 127.72 39.32 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 C-N-CA 129.505 3.122 . . . . 29.56 112.171 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . 0.54 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.7 p -103.73 177.98 4.69 Favored 'General case' 0 C--N 1.312 -1.061 0 O-C-N 118.852 -2.405 . . . . 24.64 109.444 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -70.4 -19.49 63.0 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 128.387 2.675 . . . . 24.94 111.629 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 -85.57 20.2 2.17 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 121.168 1.804 . . . . 19.79 108.59 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 42.4 mtt -133.8 163.38 29.6 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 114.152 -2.832 . . . . 20.26 108.575 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.28 12.2 p90 -154.65 151.8 29.22 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 101.97 -3.344 . . . . 13.1 101.97 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 1.5 p -117.66 163.46 16.43 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 115.989 -2.284 . . . . 22.86 105.909 179.81 86.989 -86.306 -82.553 106.2 2.008 102.021 -75.327 -55.271 1 1 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -151.25 148.81 28.66 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 125.884 1.99 . . . . 16.71 106.157 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.56 171.54 18.22 Favored Glycine 0 C--N 1.297 -1.583 0 C-N-CA 129.601 3.477 . . . . 18.89 108.793 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . . 47.1 m-85 -87.78 139.16 30.81 Favored 'General case' 0 C--O 1.269 2.12 0 C-N-CA 130.282 3.433 . . . . 25.97 111.121 178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -70.29 154.55 94.43 Favored Pre-proline 0 C--O 1.26 1.616 0 N-CA-C 104.499 -2.408 . . . . 34.1 104.499 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.51 -17.63 57.77 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 N-CA-C 107.142 -1.907 . . . . 40.58 107.142 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -32.83 22.51 Favored 'General case' 0 C--O 1.251 1.169 0 O-C-N 127.562 3.038 . . . . 50.0 111.329 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.4 -19.01 43.81 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.027 1.454 . . . . 48.48 109.123 -177.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 52.05 57.88 11.96 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 113.212 -1.813 . . . . 49.49 112.015 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . 0.473 ' O ' ' O ' ' H' ' 532' ' ' HOH . 0.0 OUTLIER -146.1 149.93 34.97 Favored 'General case' 0 C--O 1.248 0.978 0 N-CA-C 102.222 -3.251 . . . . 45.11 102.222 173.136 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . 0.727 ' CG ' ' O ' ' H' ' 532' ' ' HOH . 8.5 mtp85 -130.94 -172.32 2.79 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 126.527 2.392 . . . . 36.1 108.637 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . 0.445 ' CA ' ' O ' ' H' ' 17' ' ' VAL . . . 130.5 141.95 5.03 Favored Glycine 0 N--CA 1.475 1.291 0 N-CA-C 107.284 -2.326 . . . . 27.14 107.284 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -177.03 158.75 1.58 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 126.245 1.791 . . . . 27.49 108.887 -178.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.43 176.07 1.55 Allowed 'General case' 0 C--O 1.255 1.387 0 N-CA-C 101.127 -3.657 . . . . 31.82 101.127 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -171.54 178.4 3.18 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 104.003 -2.591 . . . . 33.6 104.003 -179.977 -166.571 60.241 84.019 104.799 2.051 101.85 -164.273 -60.742 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . 0.498 ' O ' ' N ' ' H' ' 143' ' ' ASN . 0.0 OUTLIER -42.18 123.61 2.51 Favored 'General case' 0 C--O 1.252 1.206 0 CA-C-O 113.012 -3.375 . . . . 50.0 107.849 -178.161 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . 0.75 ' N ' ' O ' ' H' ' 491' ' ' HOH . . . 102.08 -23.79 33.35 Favored Glycine 0 C--O 1.253 1.303 1 O-C-N 129.871 4.482 . . . . 27.93 116.458 178.145 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -79.63 -22.92 42.99 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.248 0.832 . . . . 25.08 113.248 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 0.49 ' OG ' ' NE2' ' H' ' 57' ' ' HIS . 0.1 OUTLIER -40.63 151.24 0.06 Allowed 'General case' 0 CA--C 1.493 -1.236 0 O-C-N 127.538 3.024 . . . . 29.62 109.106 -173.914 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 74.11 -2.03 45.56 Favored Glycine 0 C--N 1.302 -1.357 0 CA-C-O 124.12 1.955 . . . . 13.54 112.774 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -83.09 177.94 53.09 Favored Glycine 0 C--O 1.256 1.506 1 O-C-N 115.189 -4.712 . . . . 12.25 111.298 177.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.92 146.88 6.81 Favored 'Trans proline' 0 C--N 1.344 0.31 0 CA-C-N 111.075 -2.563 . . . . 13.31 116.461 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -115.71 109.69 18.06 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 100.367 -3.938 . . . . 13.98 100.367 169.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 30.5 m -119.79 157.74 21.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 1 O-C-N 115.994 -4.191 . . . . 12.64 110.385 -175.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 86.6 mtp -134.83 158.47 44.13 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 114.584 -2.627 . . . . 16.76 104.756 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 34.5 tttt -105.2 125.56 51.12 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 127.889 3.243 . . . . 13.27 108.65 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 28.7 t -68.89 122.85 86.55 Favored Pre-proline 0 C--O 1.264 1.839 0 CA-C-O 125.59 2.614 . . . . 19.49 112.072 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -68.9 -16.0 40.78 Favored 'Trans proline' 0 N--CA 1.482 0.825 0 CA-C-N 111.615 -1.959 . . . . 22.06 111.173 178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 54.5 m-85 -89.12 -50.06 6.38 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 118.061 -2.899 . . . . 23.82 111.076 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.456 ' O ' ' CB ' ' H' ' 205' ' ' ASN . 0.1 OUTLIER -117.67 5.37 12.33 Favored 'General case' 0 C--O 1.252 1.228 0 C-N-CA 115.681 -2.408 . . . . 18.69 112.976 -179.423 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . 0.456 ' CB ' ' O ' ' H' ' 204' B ASN . 1.4 m120 70.14 14.13 7.71 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 118.512 2.782 . . . . 34.83 118.512 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 32.7 mtt180 -93.64 151.66 19.52 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 127.371 2.92 . . . . 24.16 112.865 178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -88.62 131.9 34.78 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 115.972 -1.966 . . . . 14.43 109.142 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -119.55 134.57 55.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 127.391 2.932 . . . . 15.13 114.7 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -77.97 110.91 13.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 125.126 3.603 . . . . 11.37 109.667 176.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 79.7 mmm -90.34 -36.59 14.57 Favored 'General case' 0 N--CA 1.484 1.233 1 O-C-N 114.8 -4.938 . . . . 20.86 111.94 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -131.75 173.69 20.45 Favored Glycine 0 C--O 1.26 1.737 0 O-C-N 119.572 -1.955 . . . . 11.91 111.768 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 15.2 mt -126.1 130.37 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 CA-C-O 113.348 -3.215 . . . . 14.41 106.38 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 44.5 t -59.03 114.85 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 122.536 2.426 . . . . 17.01 106.371 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 35.8 t -110.92 -71.72 0.75 Allowed 'General case' 0 C--O 1.25 1.082 0 CA-C-O 112.62 -3.562 . . . . 24.2 111.567 -171.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 67.9 p-90 -153.74 170.5 20.76 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 122.244 2.293 . . . . 30.19 110.788 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -163.71 175.68 39.87 Favored Glycine 0 N--CA 1.475 1.238 0 N-CA-C 109.562 -1.415 . . . . 31.67 109.562 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -122.65 95.04 4.47 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.032 -1.84 . . . . 44.47 106.032 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 84.35 -161.78 37.64 Favored Glycine 0 N--CA 1.51 3.604 0 N-CA-C 103.975 -3.65 . . . . 33.07 103.975 -174.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 78.3 m -133.63 118.72 18.53 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 125.542 1.537 . . . . 38.22 109.321 177.748 -60.742 -164.273 84.019 101.85 2.051 104.799 60.241 -166.571 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . 0.511 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 18.5 t0 58.21 41.0 24.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 117.347 -1.741 . . . . 37.63 111.359 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . 0.575 ' NE ' ' OE1' ' H' ' 146' ' ' GLU . 5.7 mmt85 -83.84 144.37 29.3 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.499 2.999 . . . . 42.5 107.046 175.908 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -72.75 144.28 47.66 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 123.916 3.053 . . . . 46.86 109.166 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.42 13.42 65.24 Favored Glycine 0 C--O 1.25 1.133 0 CA-C-O 114.829 -3.206 . . . . 34.72 110.385 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . 0.723 ' CG ' ' O ' ' H' ' 514' ' ' HOH . 12.3 mmtt -119.72 157.54 28.34 Favored 'General case' 0 C--O 1.269 2.117 0 CA-C-N 122.188 2.994 . . . . 43.75 103.874 172.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -129.99 167.92 17.5 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 114.526 1.306 . . . . 27.31 114.526 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -92.22 143.82 16.75 Favored Glycine 0 CA--C 1.54 1.635 0 CA-C-O 114.422 -3.432 . . . . 20.41 107.174 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . 0.509 ' CE2' ' CD1' ' H' ' 176' ' ' ILE . 38.8 m-85 -107.76 136.62 47.19 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 130.806 4.474 . . . . 22.92 107.268 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -129.82 140.67 50.97 Favored 'General case' 0 C--O 1.259 1.569 0 O-C-N 126.458 2.349 . . . . 13.58 111.806 -175.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 4.8 m -70.14 133.64 47.33 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 123.73 1.729 . . . . 14.77 107.683 175.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -77.92 92.63 4.31 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 119.389 -2.069 . . . . 19.14 111.199 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 30.2 t -54.22 -48.54 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.063 0 O-C-N 120.107 -1.62 . . . . 17.69 108.31 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -60.04 -46.23 90.22 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 122.982 2.628 . . . . 21.8 113.035 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 9.8 mtp-105 -57.77 -23.87 54.4 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 113.302 -3.237 . . . . 43.58 108.283 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 16.1 mt -103.8 15.07 29.6 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 122.121 2.237 . . . . 20.61 108.196 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -59.23 -34.4 72.15 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 119.555 3.169 . . . . 37.39 119.555 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . 1.023 ' N ' ' CD ' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -74.38 -27.53 60.69 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 119.843 -1.786 . . . . 47.27 112.936 -178.966 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 57.4 t90 -68.31 -39.39 82.05 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 103.809 -2.663 . . . . 27.15 103.809 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 55.6 mt -58.22 -57.22 11.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 O-C-N 119.296 -2.127 . . . . 28.54 111.135 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -51.57 -51.97 51.07 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 125.545 2.593 . . . . 50.0 110.268 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -46.25 -56.33 5.92 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 109.958 -3.292 . . . . 50.0 111.675 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.276 1.5 m -66.14 -36.87 78.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 C-N-CA 117.391 -1.724 . . . . 35.81 111.673 -174.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 33.0 mt -64.7 -45.5 95.08 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 113.902 -1.499 . . . . 40.82 111.058 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -21.13 61.16 Favored 'General case' 0 C--O 1.252 1.195 0 N-CA-C 114.206 1.187 . . . . 50.0 114.206 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 124.42 2.057 . . . . 50.0 112.233 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 t70 . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 122.785 1.279 . . . . 50.0 107.889 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -72.05 132.13 43.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.013 -2.358 . . . . 45.72 108.052 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -75.84 155.02 35.74 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 103.76 -2.681 . . . . 48.29 103.76 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.04 139.14 58.45 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 129.471 3.108 . . . . 50.0 110.159 -179.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 28.5 pt -111.39 152.99 44.28 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-N 114.717 -1.129 . . . . 48.16 109.152 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -54.42 137.83 72.75 Favored 'Trans proline' 0 C--O 1.241 0.635 0 O-C-N 125.08 2.095 . . . . 49.8 110.693 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' I' ' 63' ' ' TYR . . . -64.88 -28.15 73.07 Favored Glycine 0 C--O 1.252 1.264 0 N-CA-C 110.554 -1.019 . . . . 49.82 110.554 179.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -58.1 -23.89 56.58 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 116.245 -2.182 . . . . 50.0 106.426 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' TYR . . . . . 0.413 ' N ' ' C ' ' I' ' 61' ' ' GLY 0.456 12.9 m-85 -80.67 -16.56 53.67 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 112.891 -1.959 . . . . 49.46 111.415 -172.114 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 64' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 N--CA 1.479 1.021 1 CA-C-O 135.558 7.361 . . . . 50.0 108.619 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 531' ' ' HOH . . . . . 0.716 ' O ' ' NH2' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 404' ' ' HOH . . . . . 0.568 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 422' ' ' HOH . . . . . 0.865 ' O ' ' NZ ' ' H' ' 169' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 466' ' ' HOH . . . . . 0.408 ' O ' ' NE ' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 469' ' ' HOH . . . . . 0.76 ' O ' ' NH2' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 476' ' ' HOH . . . . . 0.529 ' O ' ' CD ' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 480' ' ' HOH . . . . . 0.592 ' O ' ' ND2' ' H' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 486' ' ' HOH . . . . . 0.461 ' O ' ' NH2' ' H' ' 35' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 491' ' ' HOH . . . . . 0.75 ' O ' ' N ' ' H' ' 193' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 499' ' ' HOH . . . . . 0.545 ' O ' ' NH2' ' H' ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 509' ' ' HOH . . . . . 0.779 ' O ' ' N ' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . 0.436 ' O ' ' CE ' ' H' ' 36' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 514' ' ' HOH . . . . . 0.723 ' O ' ' CG ' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 519' ' ' HOH . . . . . 0.56 ' O ' ' CB ' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . 0.698 ' O ' ' CE ' ' H' ' 60' F LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 532' ' ' HOH . . . . . 0.727 ' O ' ' CG ' ' H' ' 187' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . . . . . . . . . 37.0 t0 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 100.81 -3.774 . . . . 50.0 100.81 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 5.1 p -52.25 145.0 11.57 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 126.475 2.359 . . . . 24.26 112.966 -172.501 81.869 65.075 106.673 109.124 2.008 97.57 -66.092 -52.206 1 1 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.66 7.69 29.38 Favored Glycine 0 C--O 1.255 1.468 0 CA-C-O 114.793 -3.226 . . . . 16.5 117.39 173.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 75.8 mt -102.29 107.8 18.96 Favored 'General case' 0 C--N 1.322 -0.617 1 CA-C-O 111.172 -4.251 . . . . 17.27 103.47 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -74.4 139.17 74.85 Favored Pre-proline 0 C--O 1.245 0.857 1 O-C-N 129.947 4.529 . . . . 16.54 111.034 -178.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . 0.544 ' HA ' ' HG3' ' L' ' 9' ' ' LYS 0.305 12.3 Cg_exo -64.29 -37.55 39.81 Favored 'Trans proline' 0 C--O 1.254 1.319 0 O-C-N 118.842 -1.188 . . . . 23.3 113.634 -178.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.59 -2.25 54.4 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 118.472 -2.642 . . . . 20.37 111.604 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -123.46 -88.03 0.62 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.679 1.581 . . . . 19.27 107.412 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -51.2 -54.22 27.66 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-O 117.745 -1.121 . . . . 20.24 113.037 -177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.544 ' HG3' ' HA ' ' L' ' 5' ' ' PRO . 25.6 mmtp -51.18 -29.0 12.6 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 126.034 1.733 . . . . 36.45 115.235 178.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -113.1 5.71 17.24 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.735 -1.209 . . . . 31.18 107.735 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t 58.17 46.08 16.5 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 113.839 -1.528 . . . . 28.62 113.4 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 51.5 mt -114.08 146.16 40.62 Favored 'General case' 0 C--O 1.254 1.316 0 N-CA-C 105.848 -1.908 . . . . 25.64 105.848 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -100.93 146.59 27.17 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-O 114.369 -2.729 . . . . 41.68 107.531 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -83.94 167.15 17.22 Favored 'General case' 0 C--O 1.25 1.091 1 CA-C-O 128.995 4.236 . . . . 20.5 104.514 173.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER -67.49 -12.23 59.82 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-N 109.738 -3.392 . . . . 49.08 116.689 -171.312 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 54.1 p -135.75 0.18 2.66 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 122.922 2.601 . . . . 24.4 110.778 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . 0.458 ' O ' ' HB2' ' L' ' 14' F LEU . 11.0 pt-20 -49.45 -43.33 44.79 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 128.633 3.708 . . . . 20.88 109.403 178.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.498 ' CZ ' ' OE2' ' L' ' 14' H GLU . 0.0 OUTLIER -40.6 -45.69 2.38 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 123.433 2.833 . . . . 50.0 113.548 178.43 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 15.1 tt0 -60.07 -39.51 86.3 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 128.172 2.589 . . . . 37.64 108.915 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . 0.458 ' HB2' ' O ' ' L' ' 14' C GLU . 3.9 mp -59.5 -57.45 12.9 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 119.765 -1.834 . . . . 22.29 112.16 171.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . . . . . . . . . 1.8 mm? -64.52 -33.66 76.42 Favored 'General case' 0 C--N 1.316 -0.85 1 CA-C-O 128.763 4.125 . . . . 28.57 111.564 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.498 ' OE2' ' CZ ' ' L' ' 14' D ARG . 95.8 mt-10 -68.13 -25.09 65.12 Favored 'General case' 0 C--N 1.305 -1.344 1 O-C-N 115.681 -4.387 . . . . 35.24 105.509 179.466 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.499 ' C ' ' H ' ' L' ' 14' K ILE . 76.0 p -85.47 -12.83 50.91 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 114.945 -2.455 . . . . 29.54 115.699 178.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 0.561 ' C ' HG12 ' L' ' 14' K ILE . 7.1 m-85 -91.64 48.72 1.49 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 102.336 -3.209 . . . . 33.21 102.336 -179.339 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . 0.561 HG12 ' C ' ' L' ' 14' J TYR 0.343 0.2 OUTLIER . . . . . 0 C--O 1.259 1.576 1 CA-C-N 107.899 -4.228 . . . . 48.91 107.523 -171.968 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' H' ' 189' ' ' ASP . 10.5 mm . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 102.315 -3.217 . . . . 20.74 102.315 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.894 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 73.8 t -109.2 121.29 62.02 Favored 'Isoleucine or valine' 0 C--O 1.265 1.921 0 C-N-CA 130.505 3.522 . . . . 28.27 106.406 176.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.734 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 77.4 mm-40 72.62 32.89 1.45 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.719 1.887 . . . . 45.72 114.157 -178.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.55 -175.06 29.76 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 125.697 2.832 . . . . 30.8 109.175 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 56.3 p -129.52 166.89 18.75 Favored 'General case' 0 C--O 1.254 1.323 0 N-CA-C 103.027 -2.953 . . . . 36.88 103.027 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -64.84 133.1 51.21 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 128.35 3.531 . . . . 35.08 109.134 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.97 152.86 43.96 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 105.847 -1.908 . . . . 26.85 105.847 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -78.44 165.28 23.96 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 126.702 2.001 . . . . 30.92 108.318 170.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 mm -68.94 147.61 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 119.256 -2.152 . . . . 24.61 107.007 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 52.59 22.19 10.81 Favored Glycine 0 N--CA 1.439 -1.119 0 C-N-CA 128.217 2.818 . . . . 19.33 117.393 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 6.2 ttt -70.7 -33.31 70.76 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 122.054 2.927 . . . . 20.5 114.745 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.325 0.6 OUTLIER -133.75 67.46 74.76 Favored Pre-proline 0 C--N 1.297 -1.705 0 C-N-CA 129.558 3.143 . . . . 24.26 112.225 -178.768 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -70.98 -5.51 17.12 Favored 'Trans proline' 0 C--N 1.284 -2.832 0 O-C-N 123.781 1.411 . . . . 16.92 113.344 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.8 p90 -94.11 -4.72 48.75 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 116.974 -1.489 . . . . 13.49 109.257 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -68.72 128.32 36.24 Favored 'General case' 0 C--O 1.263 1.789 0 CA-C-N 121.066 1.757 . . . . 21.32 110.443 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 69.4 t -116.93 148.17 19.83 Favored 'Isoleucine or valine' 0 C--O 1.252 1.23 0 O-C-N 121.801 -0.562 . . . . 18.58 110.276 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . 0.412 ' HG3' HD12 ' H' ' 40' ' ' LEU . 42.8 ttm -106.48 126.33 52.13 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 106.419 -1.697 . . . . 23.18 106.419 176.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' H' ' 33' ' ' LEU . 0.8 OUTLIER -84.63 113.2 21.1 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 106.874 -1.528 . . . . 28.6 106.874 172.514 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -125.32 133.68 52.51 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-O 127.305 3.431 . . . . 28.74 110.921 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.801 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 25.9 ttt180 -77.23 122.77 25.52 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 109.435 -3.53 . . . . 38.7 111.316 175.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.696 ' HE2' ' O ' ' H' ' 513' ' ' HOH . 12.1 mttt -57.9 -52.2 66.46 Favored 'General case' 0 C--O 1.258 1.536 0 CA-C-N 113.529 -1.669 . . . . 39.99 112.625 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -152.34 117.79 3.02 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 124.911 1.382 . . . . 47.76 113.868 -179.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . 0.531 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 8.4 Cg_endo -70.34 133.19 25.59 Favored 'Cis proline' 0 C--N 1.32 -0.97 0 N-CA-C 106.151 -2.288 . . . . 42.39 106.151 -1.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.801 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 41.1 mt-30 -52.37 116.42 2.24 Favored 'General case' 0 C--N 1.29 -2.006 0 C-N-CA 130.46 3.504 . . . . 50.0 107.27 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' H' ' 37' ' ' PRO . 17.8 pt-20 -166.61 154.48 9.89 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 126.981 2.676 . . . . 47.62 112.019 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . 0.412 HD12 ' HG3' ' H' ' 32' ' ' MET . 3.7 tp -73.48 120.31 18.91 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.14 -1.8 . . . . 34.91 106.14 -178.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.423 HD23 HD22 ' H' ' 64' ' ' LEU . 0.0 OUTLIER -88.83 -56.33 3.34 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 127.833 3.208 . . . . 28.34 109.994 175.028 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.288 4.6 m -164.59 -177.16 4.66 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 118.848 -2.407 . . . . 21.24 105.946 -175.174 -86.582 -164.453 -96.651 104.828 2.0 108.431 -83.191 -75.591 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -101.26 175.05 25.61 Favored Glycine 0 C--O 1.27 2.383 0 N-CA-C 105.127 -3.189 . . . . 17.37 105.127 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -165.42 -179.06 5.29 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 101.358 -3.571 . . . . 11.15 101.358 -179.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 32.4 p -141.39 147.37 37.9 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 126.311 2.257 . . . . 15.02 110.375 176.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . 0.843 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -85.67 128.01 34.66 Favored 'General case' 0 C--O 1.248 0.988 0 N-CA-C 105.997 -1.853 . . . . 19.34 105.997 179.249 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.18 -14.85 10.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 125.397 1.479 . . . . 18.16 112.297 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . 0.843 ' O ' HD22 ' H' ' 46' ' ' LEU . 58.4 p -166.34 176.09 7.74 Favored 'General case' 0 C--O 1.273 2.316 0 CA-C-O 116.549 -1.691 . . . . 28.02 108.004 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.5 -15.37 49.83 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 113.93 -2.938 . . . . 35.92 115.701 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 1.061 ' HG2' HH11 ' H' ' 50' ' ' ARG 0.283 0.0 OUTLIER -124.2 -8.69 7.62 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 114.697 -2.573 . . . . 49.01 112.885 -178.057 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -119.79 130.37 54.9 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 120.42 1.464 . . . . 24.46 113.54 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . 0.505 HG21 HD21 ' H' ' 108' ' ' LEU . 66.1 t -120.59 139.38 48.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 115.321 -2.276 . . . . 22.41 109.072 -178.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 27.3 tp -115.52 137.87 51.62 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 125.025 1.453 . . . . 20.79 112.847 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 6.0 t -155.98 175.86 13.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 124.797 1.239 . . . . 18.32 111.939 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.93 136.45 37.26 Favored 'General case' 0 C--O 1.266 1.951 0 N-CA-C 107.71 -1.218 . . . . 16.88 107.71 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -29.26 69.76 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 115.12 -2.371 . . . . 16.83 112.681 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -72.75 -9.21 58.38 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 120.489 1.495 . . . . 24.33 111.152 -172.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 55.0 m -73.74 -30.9 63.07 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 126.148 2.155 . . . . 24.17 109.791 175.812 -75.591 -83.191 -96.651 108.431 2.0 104.828 -164.453 -86.582 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -98.49 -46.16 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 O-C-N 120.899 -1.125 . . . . 25.24 111.776 -176.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 51.7 tp -128.08 110.3 12.35 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.141 1.776 . . . . 27.73 113.734 -175.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 39.3 t80 -149.23 83.2 6.68 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 113.989 -1.46 . . . . 27.95 110.222 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . . . . . . . . 0.287 23.3 Cg_exo -50.67 -34.41 43.55 Favored 'Trans proline' 0 CA--C 1.495 -1.459 0 C-N-CA 124.456 3.437 . . . . 28.97 117.726 -178.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . . . . . . . . . 4.5 Cg_exo -64.0 -14.59 44.31 Favored 'Trans proline' 0 C--N 1.305 -1.762 0 CA-C-N 122.96 2.093 . . . . 32.2 112.514 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . . . . . . . . . 45.8 m0 -121.34 18.31 11.43 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.071 -1.825 . . . . 42.33 106.071 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . . 11.9 m-20 54.63 35.85 24.67 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 114.352 -2.939 . . . . 45.89 113.111 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . 0.73 ' HE2' ' O ' ' H' ' 527' ' ' HOH . 30.7 ttmt -103.39 113.71 27.42 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 123.235 1.493 . . . . 33.91 107.94 175.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . . . . . . . . . 59.1 t-20 -151.37 82.02 1.3 Allowed 'General case' 0 C--O 1.252 1.2 0 CA-C-N 112.76 -2.018 . . . . 39.76 109.653 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 25.6 m-85 -81.1 132.44 35.36 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.473 1.509 . . . . 33.17 114.356 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.466 ' HB ' ' OD2' ' H' ' 63' ' ' ASP 0.279 0.8 OUTLIER -98.07 165.68 11.79 Favored 'General case' 0 C--O 1.248 0.997 0 CA-C-O 126.15 2.881 . . . . 35.55 111.888 174.134 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . 0.77 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.2 OUTLIER -50.3 -48.8 54.93 Favored 'General case' 0 C--O 1.268 2.07 1 O-C-N 115.497 -4.502 . . . . 47.58 115.323 175.854 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HE3' ' H' ' 36' ' ' LYS . 6.1 m-20 -59.22 -24.27 63.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 113.796 -1.547 . . . . 50.0 113.535 177.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.466 ' OD2' ' HB ' ' H' ' 60' I THR . 9.2 m-20 -77.91 -12.93 60.02 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-O 112.2 -3.762 . . . . 44.79 114.373 -175.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.423 HD22 HD23 ' H' ' 41' ' ' LEU . 0.3 OUTLIER -138.45 169.27 18.08 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 128.353 3.533 . . . . 30.41 115.734 -173.907 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . 0.508 HD22 ' HG2' ' H' ' 36' ' ' LYS . 0.0 OUTLIER -124.65 150.28 46.24 Favored 'General case' 0 C--N 1.301 -1.505 1 CA-C-N 107.881 -4.236 . . . . 26.67 109.746 172.141 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.331 0.9 OUTLIER -114.71 121.46 66.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 CA-C-O 125.853 2.739 . . . . 25.22 107.954 171.387 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . 0.412 ' HB2' ' HB3' ' H' ' 32' ' ' MET . 76.6 mtp180 -111.38 112.67 24.59 Favored 'General case' 0 C--O 1.252 1.2 0 O-C-N 116.856 -3.652 . . . . 21.83 112.681 177.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.2 137.6 41.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 127.426 2.29 . . . . 22.03 115.101 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.55 48.39 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 124.957 1.265 . . . . 17.81 114.141 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' H' ' 72' ' ' SER . 19.3 mtpp -81.78 159.18 23.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.138 0.97 . . . . 19.66 113.551 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.413 ' CD2' HG22 ' H' ' 154' ' ' VAL . 52.7 t60 -135.2 -57.46 0.8 Allowed 'General case' 0 C--O 1.259 1.58 0 C-N-CA 128.992 2.917 . . . . 24.07 105.017 179.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.71 ' OG ' ' HG2' ' H' ' 75' ' ' ARG . 33.1 t -69.92 136.43 50.58 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 111.014 -2.812 . . . . 24.04 108.53 177.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 52.0 ttp85 -69.72 -47.68 62.24 Favored 'General case' 0 C--O 1.258 1.531 0 C-N-CA 123.76 0.824 . . . . 35.97 111.734 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 20.2 p -109.08 -13.86 14.63 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 119.931 3.308 . . . . 28.74 119.931 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 0.879 ' HG3' HH11 ' H' ' 75' ' ' ARG . 0.1 OUTLIER -75.97 157.66 32.86 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 121.202 1.819 . . . . 44.15 113.476 173.139 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -97.07 98.61 10.2 Favored 'General case' 0 C--O 1.258 1.545 0 N-CA-C 103.234 -2.876 . . . . 34.22 103.234 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -82.02 82.47 7.6 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 127.435 3.493 . . . . 27.14 112.521 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.568 ' O ' ' O ' ' H' ' 404' ' ' HOH . 18.0 ttp85 -53.94 126.71 23.44 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 128.908 2.883 . . . . 27.73 107.869 -179.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' H' ' 77' A ARG . 98.9 m-20 75.83 -12.94 0.93 Allowed 'General case' 0 C--O 1.255 1.343 0 CA-C-N 109.823 -3.353 . . . . 31.93 112.62 -177.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.81 -56.39 5.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 118.945 -2.347 . . . . 23.68 111.588 -178.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . 0.572 ' O ' ' HD2' ' H' ' 81' ' ' LYS . 4.4 pt-20 -82.8 147.73 28.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 O-C-N 127.106 2.754 . . . . 24.47 114.7 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' H' ' 80' ' ' GLU . 8.2 mptt -120.29 129.2 53.91 Favored 'General case' 0 C--N 1.303 -1.413 0 C-N-CA 128.676 2.79 . . . . 42.46 105.085 175.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 84.2 mt -110.15 125.69 67.38 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 CA-C-O 113.066 -3.35 . . . . 28.18 107.269 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -131.06 173.87 10.58 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 125.468 2.556 . . . . 37.31 110.09 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . 0.523 ' HE1' ' O ' ' H' ' 513' ' ' HOH . 0.5 OUTLIER -114.61 142.56 46.28 Favored 'General case' 0 C--N 1.314 -0.951 1 CA-C-N 107.181 -4.554 . . . . 40.75 105.663 -177.403 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.928 HD13 ' HE2' ' H' ' 106' ' ' MET . 22.1 mt -88.42 139.52 30.41 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 130.89 5.119 . . . . 34.69 109.216 -179.219 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . 0.453 ' OE1' ' NH2' ' H' ' 50' ' ' ARG . 30.2 tt0 -94.68 -35.75 12.04 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.94 -2.245 . . . . 45.85 104.94 178.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.77 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 2.2 tmtt? -163.85 145.87 9.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 116.053 -2.259 . . . . 41.41 112.076 -176.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.628 ' H ' ' HD3' ' H' ' 87' ' ' LYS . 62.1 mt -114.83 130.81 68.65 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 O-C-N 127.601 3.063 . . . . 29.59 111.809 177.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -122.69 127.53 49.39 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 116.188 -1.863 . . . . 39.58 109.888 174.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.57 150.56 8.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 C-N-CA 126.497 1.919 . . . . 23.49 109.188 177.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -64.42 130.57 94.73 Favored Pre-proline 0 C--O 1.254 1.298 0 CA-C-N 122.419 2.372 . . . . 21.31 107.95 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -55.55 -30.93 76.59 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 122.213 1.942 . . . . 27.37 111.71 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -109.36 26.82 10.19 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-N 121.306 1.866 . . . . 45.32 114.019 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . 0.286 2.4 t80 -53.06 137.6 32.94 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 114.81 -2.519 . . . . 22.4 108.387 174.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -113.44 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.38 1 CA-C-N 126.966 4.439 . . . . 28.82 110.64 -178.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -86.32 -13.61 46.06 Favored 'General case' 0 C--O 1.26 1.645 0 CA-C-O 115.817 -2.04 . . . . 28.47 108.512 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 43.8 mtt-85 -77.96 -40.5 39.17 Favored 'General case' 0 C--O 1.241 0.614 0 O-C-N 126.283 2.239 . . . . 38.01 113.698 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . . . . . . . . . 8.1 tt0 -106.25 -62.28 1.4 Allowed 'General case' 0 C--O 1.251 1.134 0 CA-C-O 113.209 -3.282 . . . . 42.72 113.322 -176.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' H' ' 99' ' ' LEU . 33.2 p30 -138.04 12.77 2.87 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 115.42 -2.229 . . . . 27.22 114.521 -174.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' H' ' 98' ' ' ASN . 10.6 mt 65.65 37.48 5.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 123.902 3.046 . . . . 29.74 112.564 -175.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -72.22 136.71 46.45 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 112.47 -3.633 . . . . 25.36 103.27 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 66.25 35.95 5.69 Favored 'General case' 0 C--N 1.314 -0.939 1 O-C-N 131.662 5.601 . . . . 27.82 112.873 -179.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -67.61 82.99 0.17 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 116.591 -1.671 . . . . 13.38 107.13 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.496 HD11 HD11 ' H' ' 238' ' ' ILE . 7.1 tt -150.44 147.56 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 CA-C-O 116.088 -1.911 . . . . 15.98 108.675 -178.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -154.77 146.11 22.97 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 108.11 -1.07 . . . . 19.5 108.11 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.47 145.53 34.52 Favored 'General case' 0 C--O 1.258 1.522 0 C-N-CA 125.401 1.48 . . . . 24.96 108.075 173.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.928 ' HE2' HD13 ' H' ' 85' ' ' LEU . 39.2 mtp -123.14 126.45 47.04 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 114.756 -2.545 . . . . 32.02 106.582 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . 0.756 ' NZ ' ' NE ' ' H' ' 50' ' ' ARG . 41.5 tttp -94.58 123.27 37.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 113.069 -3.348 . . . . 41.0 106.105 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . 0.505 HD21 HG21 ' H' ' 52' ' ' VAL . 33.8 mt -77.72 144.67 37.07 Favored 'General case' 0 N--CA 1.5 2.057 1 O-C-N 130.758 5.036 . . . . 28.05 108.875 -177.969 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . 0.45 ' HA ' ' HB2' ' H' ' 86' ' ' GLU . 3.5 tptm -60.9 -25.73 66.94 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 121.205 1.82 . . . . 48.37 107.719 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -158.18 149.44 16.61 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 119.575 -1.953 . . . . 50.0 109.648 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.21 146.54 95.92 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 O-C-N 126.327 2.751 . . . . 32.93 110.069 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . 0.306 4.4 p -99.13 146.52 8.34 Favored 'Isoleucine or valine' 0 C--O 1.252 1.217 1 CA-C-N 106.798 -4.728 . . . . 29.84 105.416 178.682 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.02 134.65 36.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 111.343 -2.662 . . . . 25.94 108.39 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . 0.456 ' HD1' ' HA ' ' H' ' 114' ' ' PHE . 22.2 m-30 -64.17 156.96 26.9 Favored 'General case' 0 C--O 1.254 1.338 0 C-N-CA 130.042 3.337 . . . . 22.88 107.438 176.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 4.3 p -170.4 -169.04 0.77 Allowed 'General case' 0 N--CA 1.487 1.379 1 O-C-N 130.425 4.828 . . . . 22.57 104.512 -178.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.01 -29.87 70.99 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-O 115.379 -2.248 . . . . 28.95 110.826 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -111.05 -4.3 15.15 Favored 'General case' 0 C--O 1.257 1.488 0 O-C-N 128.383 3.552 . . . . 27.81 115.858 -170.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 52.2 mt -131.62 113.91 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 1 O-C-N 131.113 5.258 . . . . 18.24 110.688 -176.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . 0.406 ' HA ' ' HD3' ' H' ' 120' ' ' PRO . 23.1 t60 -169.16 139.71 1.86 Allowed Pre-proline 0 C--O 1.258 1.523 1 O-C-N 130.606 4.942 . . . . 21.4 109.568 -174.015 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' H' ' 119' ' ' HIS . 4.6 Cg_endo -82.53 158.1 16.7 Favored 'Trans proline' 0 C--O 1.258 1.504 0 C-N-CA 122.91 2.406 . . . . 15.57 114.788 -175.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 p -98.35 157.77 3.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-N 109.29 -3.596 . . . . 14.88 105.309 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 38.7 m -92.44 153.07 19.35 Favored 'General case' 0 C--O 1.205 -1.277 0 O-C-N 125.431 1.707 . . . . 15.07 108.563 179.015 -52.206 -66.092 106.673 97.57 2.008 109.124 65.075 81.869 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' H' ' 124' ' ' PRO . 52.9 mt -102.75 133.56 20.36 Favored Pre-proline 0 C--N 1.287 -2.118 0 N-CA-C 102.222 -3.251 . . . . 15.09 102.222 175.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' H' ' 123' ' ' LEU . 9.5 Cg_endo -67.48 151.87 79.4 Favored 'Trans proline' 0 C--O 1.243 0.744 0 O-C-N 127.976 3.619 . . . . 21.0 106.337 -174.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -111.81 157.27 20.76 Favored 'General case' 0 C--O 1.26 1.652 0 N-CA-C 102.072 -3.307 . . . . 37.65 102.072 172.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' H' ' 466' ' ' HOH . 29.2 ttt180 -38.87 -37.85 0.38 Allowed 'General case' 0 C--O 1.246 0.893 0 N-CA-C 119.887 3.291 . . . . 50.0 119.887 -178.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . 0.26 0.9 OUTLIER -82.08 -27.55 32.84 Favored 'General case' 0 C--O 1.276 2.455 0 C-N-CA 117.871 -1.532 . . . . 45.72 111.992 -178.103 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 31.1 m -65.1 -52.83 53.17 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.976 -1.49 . . . . 33.53 106.976 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.61 86.72 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.719 0.771 . . . . 25.39 109.338 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -54.06 -47.8 71.28 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 116.003 -1.951 . . . . 26.19 109.701 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.7 OUTLIER -74.8 -36.88 62.47 Favored 'General case' 0 C--O 1.255 1.345 1 CA-C-O 111.678 -4.01 . . . . 32.6 117.548 -177.918 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . 0.474 HD21 ' CD ' ' H' ' 204' ' ' PRO . 29.9 mt -95.94 -28.67 14.56 Favored 'General case' 0 C--O 1.259 1.57 0 O-C-N 126.077 2.111 . . . . 25.07 115.457 -175.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.49 78.49 1.05 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 115.805 -2.358 . . . . 22.51 108.952 179.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -129.01 140.56 51.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 123.432 1.586 . . . . 45.04 113.3 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.87 134.93 55.78 Favored 'General case' 0 C--O 1.253 1.266 1 CA-C-O 106.798 -6.334 . . . . 22.54 102.403 -176.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.72 -44.9 1.38 Allowed Glycine 0 CA--C 1.54 1.628 1 O-C-N 136.387 8.555 . . . . 19.63 115.692 -177.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . 0.439 ' O ' HG13 ' H' ' 162' ' ' ILE . 2.7 m-30 -63.67 129.69 41.2 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.168 1.387 . . . . 24.75 107.963 179.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 59.2 mttt -84.65 144.61 28.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.682 -3.532 . . . . 20.73 117.056 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . 0.453 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -126.44 179.63 16.21 Favored Glycine 0 CA--C 1.549 2.199 1 O-C-N 129.236 4.085 . . . . 10.01 104.785 174.489 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -127.41 134.8 49.86 Favored 'General case' 0 C--O 1.268 2.031 0 C-N-CA 125.597 1.559 . . . . 16.32 111.297 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 21.9 t -118.95 139.88 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 126.437 1.895 . . . . 16.8 106.866 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 0.743 HG22 HG22 ' H' ' 157' ' ' VAL . 16.9 p -133.84 153.28 51.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 113.688 -3.053 . . . . 15.37 109.24 -179.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.15 37.37 Favored Glycine 0 N--CA 1.488 2.122 0 C-N-CA 115.087 -3.435 . . . . 16.98 107.325 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -108.48 22.77 15.48 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 127.157 2.328 . . . . 25.82 108.212 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -78.21 -177.59 48.25 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 125.553 2.752 . . . . 26.98 110.11 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' H' ' 150' ' ' GLY . 59.8 m-20 -50.01 138.08 16.15 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 110.507 -2.846 . . . . 36.05 109.397 179.018 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . 0.443 HD11 ' HA ' ' H' ' 152' ' ' PRO . 96.5 mt -89.04 -6.88 56.84 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 108.41 -3.996 . . . . 36.28 110.338 177.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -150.74 140.39 21.66 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 127.785 3.178 . . . . 50.0 111.275 -171.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . 0.713 ' HB2' ' O ' ' H' ' 519' ' ' HOH 0.26 27.6 tt0 . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 125.578 2.608 . . . . 48.6 107.881 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' H' ' 143' ' ' ASN . . . . . . . . 0 C--O 1.249 1.088 0 N-CA-C 116.561 1.385 . . . . 43.45 116.561 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -126.25 122.16 24.0 Favored Pre-proline 0 C--N 1.309 -1.187 0 C-N-CA 128.003 2.521 . . . . 50.0 106.738 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' H' ' 144' ' ' LEU . 1.0 OUTLIER -66.08 163.55 31.0 Favored 'Trans proline' 0 C--N 1.322 -0.848 0 O-C-N 125.611 2.374 . . . . 36.1 108.5 -174.362 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.74 -25.87 15.91 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 114.016 -3.074 . . . . 38.53 106.066 173.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.413 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.372 0.4 OUTLIER -135.67 156.68 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 115.0 -2.428 . . . . 25.88 110.591 -175.65 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.1 tp -45.83 123.11 4.17 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 130.473 3.509 . . . . 20.7 107.353 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.46 ' C ' HG23 ' H' ' 157' ' ' VAL . 73.7 mm-40 -102.59 166.56 10.45 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.476 1.11 . . . . 25.85 111.49 -177.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 0.743 HG22 HG22 ' H' ' 139' ' ' THR . 12.5 t -144.17 155.27 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 114.73 -2.557 . . . . 24.15 111.451 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -153.46 142.86 14.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-O 113.37 -3.205 . . . . 19.19 109.185 171.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -99.65 132.77 44.77 Favored 'General case' 0 C--O 1.27 2.152 0 C-N-CA 128.833 2.853 . . . . 20.4 106.456 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.7 mt -142.05 147.31 43.86 Favored Pre-proline 0 C--N 1.304 -1.37 0 O-C-N 124.328 1.018 . . . . 22.42 109.663 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . 0.409 ' HD3' ' CZ ' ' H' ' 184' A TYR . 5.1 Cg_endo -79.09 138.69 14.55 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 CA-C-O 113.106 -2.956 . . . . 18.22 115.943 179.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . 0.439 HG13 ' O ' ' H' ' 134' ' ' TYR . 3.6 mt -69.91 133.72 31.37 Favored 'Isoleucine or valine' 0 C--O 1.287 3.039 0 CA-C-N 121.202 1.819 . . . . 20.82 110.761 168.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 48.5 t -103.3 152.32 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.751 0 C-N-CA 118.413 -1.315 . . . . 18.41 109.288 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -60.12 131.69 51.61 Favored 'General case' 0 C--N 1.293 -1.866 1 C-N-CA 131.846 4.058 . . . . 44.27 107.987 -179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.597 ' CD ' ' O ' ' H' ' 422' ' ' HOH . 6.0 ttt85 -35.95 -50.96 1.61 Allowed Pre-proline 0 C--N 1.301 -1.507 0 C-N-CA 127.404 2.281 . . . . 48.84 116.911 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' H' ' 165' ' ' ARG . 6.1 Cg_exo -64.8 -49.04 3.32 Favored 'Trans proline' 0 C--O 1.259 1.53 0 C-N-CA 124.701 3.601 . . . . 27.58 112.196 -177.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . 0.508 HG11 ' HE2' ' H' ' 185' ' ' LYS . 19.2 t -52.2 -40.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 C-N-CA 119.387 -0.925 . . . . 26.06 108.67 174.917 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 59.5 m -61.14 -51.72 67.9 Favored 'General case' 0 C--O 1.269 2.1 0 O-C-N 121.135 -0.978 . . . . 23.75 108.957 178.616 -55.271 -75.327 -82.553 102.021 2.008 106.2 -86.306 86.989 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -55.54 -42.82 75.14 Favored 'General case' 0 C--O 1.26 1.65 0 CA-C-O 125.899 2.761 . . . . 37.53 118.074 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -69.03 -12.21 61.48 Favored 'General case' 0 C--N 1.281 -2.371 1 C-N-CA 134.607 5.163 . . . . 25.28 114.312 179.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 87.2 p -93.12 -15.77 25.67 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 113.891 -2.957 . . . . 25.86 108.472 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 7.0 t -139.84 175.65 9.4 Favored 'General case' 0 C--O 1.25 1.123 1 O-C-N 130.529 4.893 . . . . 27.67 115.418 -177.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -102.13 -8.63 21.22 Favored 'General case' 0 C--O 1.25 1.105 0 O-C-N 119.047 -2.283 . . . . 35.56 108.98 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 87.8 mt -76.64 135.56 26.46 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 O-C-N 128.092 3.37 . . . . 33.81 111.745 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 64.8 ttp85 -70.0 103.59 2.31 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-N 112.885 -1.961 . . . . 41.96 111.558 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . 0.851 HD12 ' CE2' ' H' ' 227' ' ' PHE . 4.4 mm -81.18 127.72 39.32 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 C-N-CA 129.505 3.122 . . . . 29.56 112.171 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . 0.535 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.7 p -103.73 177.98 4.69 Favored 'General case' 0 C--N 1.312 -1.061 0 O-C-N 118.852 -2.405 . . . . 24.64 109.444 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -70.4 -19.49 63.0 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 128.387 2.675 . . . . 24.94 111.629 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 -85.57 20.2 2.17 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 121.168 1.804 . . . . 19.79 108.59 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 42.4 mtt -133.8 163.38 29.6 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 114.152 -2.832 . . . . 20.26 108.575 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.28 12.2 p90 -154.65 151.8 29.22 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 101.97 -3.344 . . . . 13.1 101.97 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 1.5 p -117.66 163.46 16.43 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 115.989 -2.284 . . . . 22.86 105.909 179.81 86.989 -86.306 -82.553 106.2 2.008 102.021 -75.327 -55.271 2 2 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -151.25 148.81 28.66 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 125.884 1.99 . . . . 16.71 106.157 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.56 171.54 18.22 Favored Glycine 0 C--N 1.297 -1.583 0 C-N-CA 129.601 3.477 . . . . 18.89 108.793 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . 0.409 ' CZ ' ' HD3' ' H' ' 161' ' ' PRO . 47.1 m-85 -87.78 139.16 30.81 Favored 'General case' 0 C--O 1.269 2.12 0 C-N-CA 130.282 3.433 . . . . 25.97 111.121 178.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.663 ' H ' ' HG3' ' H' ' 186' B GLU . 21.1 mmtp -70.29 154.55 94.43 Favored Pre-proline 0 C--O 1.26 1.616 0 N-CA-C 104.499 -2.408 . . . . 34.1 104.499 175.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . 0.44 ' HB3' ' HB3' ' H' ' 222' ' ' ASP . 1.1 Cg_endo -65.51 -17.63 57.77 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 N-CA-C 107.142 -1.907 . . . . 40.58 107.142 -176.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -32.83 22.51 Favored 'General case' 0 C--O 1.251 1.169 0 O-C-N 127.562 3.038 . . . . 50.0 111.329 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . 0.663 ' HG3' ' H ' ' H' ' 185' ' ' LYS . 0.9 OUTLIER -59.4 -19.01 43.81 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.027 1.454 . . . . 48.48 109.123 -177.436 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 52.05 57.88 11.96 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 113.212 -1.813 . . . . 49.49 112.015 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . 0.473 ' O ' ' O ' ' H' ' 532' ' ' HOH . 0.0 OUTLIER -146.1 149.93 34.97 Favored 'General case' 0 C--O 1.248 0.978 0 N-CA-C 102.222 -3.251 . . . . 45.11 102.222 173.136 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 1.062 ' HG2' ' O ' ' H' ' 532' ' ' HOH . 8.5 mtp85 -130.94 -172.32 2.79 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 126.527 2.392 . . . . 36.1 108.637 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.894 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 130.5 141.95 5.03 Favored Glycine 0 N--CA 1.475 1.291 0 N-CA-C 107.284 -2.326 . . . . 27.14 107.284 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' H' ' 188' ' ' GLY . 25.9 t0 -177.03 158.75 1.58 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 126.245 1.791 . . . . 27.49 108.887 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.43 176.07 1.55 Allowed 'General case' 0 C--O 1.255 1.387 0 N-CA-C 101.127 -3.657 . . . . 31.82 101.127 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -171.54 178.4 3.18 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 104.003 -2.591 . . . . 33.6 104.003 -179.977 -166.571 60.241 84.019 104.799 2.051 101.85 -164.273 -60.742 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.18 123.61 2.51 Favored 'General case' 0 C--O 1.252 1.206 0 CA-C-O 113.012 -3.375 . . . . 50.0 107.849 -178.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.08 -23.79 33.35 Favored Glycine 0 C--O 1.253 1.303 1 O-C-N 129.871 4.482 . . . . 27.93 116.458 178.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -79.63 -22.92 42.99 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.248 0.832 . . . . 25.08 113.248 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.63 151.24 0.06 Allowed 'General case' 0 CA--C 1.493 -1.236 0 O-C-N 127.538 3.024 . . . . 29.62 109.106 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 74.11 -2.03 45.56 Favored Glycine 0 C--N 1.302 -1.357 0 CA-C-O 124.12 1.955 . . . . 13.54 112.774 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -83.09 177.94 53.09 Favored Glycine 0 C--O 1.256 1.506 1 O-C-N 115.189 -4.712 . . . . 12.25 111.298 177.923 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.92 146.88 6.81 Favored 'Trans proline' 0 C--N 1.344 0.31 0 CA-C-N 111.075 -2.563 . . . . 13.31 116.461 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . 0.453 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 3.9 t80 -115.71 109.69 18.06 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 100.367 -3.938 . . . . 13.98 100.367 169.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 30.5 m -119.79 157.74 21.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 1 O-C-N 115.994 -4.191 . . . . 12.64 110.385 -175.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 86.6 mtp -134.83 158.47 44.13 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 114.584 -2.627 . . . . 16.76 104.756 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 34.5 tttt -105.2 125.56 51.12 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 127.889 3.243 . . . . 13.27 108.65 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 28.7 t -68.89 122.85 86.55 Favored Pre-proline 0 C--O 1.264 1.839 0 CA-C-O 125.59 2.614 . . . . 19.49 112.072 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . 0.474 ' CD ' HD21 ' H' ' 129' C LEU . 1.8 Cg_endo -68.9 -16.0 40.78 Favored 'Trans proline' 0 N--CA 1.482 0.825 0 CA-C-N 111.615 -1.959 . . . . 22.06 111.173 178.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 54.5 m-85 -89.12 -50.06 6.38 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 118.061 -2.899 . . . . 23.82 111.076 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . 0.585 ' O ' ' HB2' ' H' ' 205' ' ' ASN . 50.1 p30 -117.67 5.37 12.33 Favored 'General case' 0 C--O 1.252 1.228 0 C-N-CA 115.681 -2.408 . . . . 18.69 112.976 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . 0.585 ' HB2' ' O ' ' H' ' 204' B ASN . 1.4 m120 70.14 14.13 7.71 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 118.512 2.782 . . . . 34.83 118.512 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' H' ' 206' ' ' ARG . 32.7 mtt180 -93.64 151.66 19.52 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 127.371 2.92 . . . . 24.16 112.865 178.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -88.62 131.9 34.78 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 115.972 -1.966 . . . . 14.43 109.142 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -119.55 134.57 55.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 127.391 2.932 . . . . 15.13 114.7 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -77.97 110.91 13.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 125.126 3.603 . . . . 11.37 109.667 176.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 79.7 mmm -90.34 -36.59 14.57 Favored 'General case' 0 N--CA 1.484 1.233 1 O-C-N 114.8 -4.938 . . . . 20.86 111.94 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.465 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -131.75 173.69 20.45 Favored Glycine 0 C--O 1.26 1.737 0 O-C-N 119.572 -1.955 . . . . 11.91 111.768 -177.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 15.2 mt -126.1 130.37 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 CA-C-O 113.348 -3.215 . . . . 14.41 106.38 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . 0.418 HG13 ' O ' ' H' ' 429' ' ' HOH . 44.5 t -59.03 114.85 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 122.536 2.426 . . . . 17.01 106.371 177.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 35.8 t -110.92 -71.72 0.75 Allowed 'General case' 0 C--O 1.25 1.082 0 CA-C-O 112.62 -3.562 . . . . 24.2 111.567 -171.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 67.9 p-90 -153.74 170.5 20.76 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 122.244 2.293 . . . . 30.19 110.788 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -163.71 175.68 39.87 Favored Glycine 0 N--CA 1.475 1.238 0 N-CA-C 109.562 -1.415 . . . . 31.67 109.562 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -122.65 95.04 4.47 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.032 -1.84 . . . . 44.47 106.032 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . 0.415 ' HA3' ' NE ' ' H' ' 221' A ARG . . . 84.35 -161.78 37.64 Favored Glycine 0 N--CA 1.51 3.604 0 N-CA-C 103.975 -3.65 . . . . 33.07 103.975 -174.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 78.3 m -133.63 118.72 18.53 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 125.542 1.537 . . . . 38.22 109.321 177.748 -60.742 -164.273 84.019 101.85 2.051 104.799 60.241 -166.571 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . 0.511 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 18.5 t0 58.21 41.0 24.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 117.347 -1.741 . . . . 37.63 111.359 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . 0.599 ' HE ' ' CD ' ' H' ' 146' ' ' GLU . 5.7 mmt85 -83.84 144.37 29.3 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.499 2.999 . . . . 42.5 107.046 175.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' H' ' 186' ' ' PRO . 14.7 m-20 -72.75 144.28 47.66 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 123.916 3.053 . . . . 46.86 109.166 179.085 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.42 13.42 65.24 Favored Glycine 0 C--O 1.25 1.133 0 CA-C-O 114.829 -3.206 . . . . 34.72 110.385 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . 1.187 ' HG3' ' O ' ' H' ' 514' ' ' HOH . 12.3 mmtt -119.72 157.54 28.34 Favored 'General case' 0 C--O 1.269 2.117 0 CA-C-N 122.188 2.994 . . . . 43.75 103.874 172.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -129.99 167.92 17.5 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 114.526 1.306 . . . . 27.31 114.526 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -92.22 143.82 16.75 Favored Glycine 0 CA--C 1.54 1.635 0 CA-C-O 114.422 -3.432 . . . . 20.41 107.174 176.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . 0.851 ' CE2' HD12 ' H' ' 176' ' ' ILE . 38.8 m-85 -107.76 136.62 47.19 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 130.806 4.474 . . . . 22.92 107.268 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -129.82 140.67 50.97 Favored 'General case' 0 C--O 1.259 1.569 0 O-C-N 126.458 2.349 . . . . 13.58 111.806 -175.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.465 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 4.8 m -70.14 133.64 47.33 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 123.73 1.729 . . . . 14.77 107.683 175.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -77.92 92.63 4.31 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 119.389 -2.069 . . . . 19.14 111.199 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 30.2 t -54.22 -48.54 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.063 0 O-C-N 120.107 -1.62 . . . . 17.69 108.31 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -60.04 -46.23 90.22 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 122.982 2.628 . . . . 21.8 113.035 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 9.8 mtp-105 -57.77 -23.87 54.4 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 113.302 -3.237 . . . . 43.58 108.283 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . 0.45 HD12 HG22 ' H' ' 229' ' ' THR . 16.1 mt -103.8 15.07 29.6 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 122.121 2.237 . . . . 20.61 108.196 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -59.23 -34.4 72.15 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 119.555 3.169 . . . . 37.39 119.555 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . 1.24 ' HD2' ' N ' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -74.38 -27.53 60.69 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 119.843 -1.786 . . . . 47.27 112.936 -178.966 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 57.4 t90 -68.31 -39.39 82.05 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 103.809 -2.663 . . . . 27.15 103.809 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.496 HD11 HD11 ' H' ' 103' ' ' ILE . 55.6 mt -58.22 -57.22 11.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 O-C-N 119.296 -2.127 . . . . 28.54 111.135 179.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.567 ' HG3' ' O ' ' H' ' 496' ' ' HOH . 2.1 mt-30 -51.57 -51.97 51.07 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 125.545 2.593 . . . . 50.0 110.268 -177.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' H' ' 236' ' ' LYS . 5.3 tttm -46.25 -56.33 5.92 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 109.958 -3.292 . . . . 50.0 111.675 179.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.276 1.5 m -66.14 -36.87 78.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 C-N-CA 117.391 -1.724 . . . . 35.81 111.673 -174.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 33.0 mt -64.7 -45.5 95.08 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 113.902 -1.499 . . . . 40.82 111.058 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -21.13 61.16 Favored 'General case' 0 C--O 1.252 1.195 0 N-CA-C 114.206 1.187 . . . . 50.0 114.206 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 124.42 2.057 . . . . 50.0 112.233 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 t70 . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 122.785 1.279 . . . . 50.0 107.889 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -72.05 132.13 43.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.013 -2.358 . . . . 45.72 108.052 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -75.84 155.02 35.74 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 103.76 -2.681 . . . . 48.29 103.76 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' I' ' 58' ' ' GLU . 0.8 OUTLIER -62.04 139.14 58.45 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 129.471 3.108 . . . . 50.0 110.159 -179.834 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 28.5 pt -111.39 152.99 44.28 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-N 114.717 -1.129 . . . . 48.16 109.152 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.515 ' HB2' ' CD ' ' I' ' 62' ' ' GLU . 5.0 Cg_exo -54.42 137.83 72.75 Favored 'Trans proline' 0 C--O 1.241 0.635 0 O-C-N 125.08 2.095 . . . . 49.8 110.693 179.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' I' ' 63' ' ' TYR . . . -64.88 -28.15 73.07 Favored Glycine 0 C--O 1.252 1.264 0 N-CA-C 110.554 -1.019 . . . . 49.82 110.554 179.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLU . . . . . 0.515 ' CD ' ' HB2' ' I' ' 60' ' ' PRO . 16.8 pm0 -58.1 -23.89 56.58 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 116.245 -2.182 . . . . 50.0 106.426 -178.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 63' ' ' TYR . . . . . 0.443 ' CD2' ' HG2' ' I' ' 60' ' ' PRO 0.456 12.9 m-85 -80.67 -16.56 53.67 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 112.891 -1.959 . . . . 49.46 111.415 -172.114 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 64' ' ' LEU . . . . . 0.612 HD23 ' HD3' ' H' ' 36' ' ' LYS . 4.3 mt . . . . . 0 N--CA 1.479 1.021 1 CA-C-O 135.558 7.361 . . . . 50.0 108.619 174.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 404' ' ' HOH . . . . . 0.568 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 422' ' ' HOH . . . . . 0.597 ' O ' ' CD ' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 429' ' ' HOH . . . . . 0.418 ' O ' HG13 ' H' ' 213' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 466' ' ' HOH . . . . . 0.408 ' O ' ' NE ' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 469' ' ' HOH . . . . . 0.76 ' O ' ' NH2' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 476' ' ' HOH . . . . . 0.971 ' O ' ' HD2' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 486' ' ' HOH . . . . . 0.455 ' O ' ' NH2' ' H' ' 35' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 496' ' ' HOH . . . . . 0.567 ' O ' ' HG3' ' H' ' 239' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 509' ' ' HOH . . . . . 0.401 ' O ' ' N ' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 513' ' ' HOH . . . . . 0.696 ' O ' ' HE2' ' H' ' 36' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 514' ' ' HOH . . . . . 1.187 ' O ' ' HG3' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 519' ' ' HOH . . . . . 0.713 ' O ' ' HB2' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . 0.73 ' O ' ' HE2' ' H' ' 60' F LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 532' ' ' HOH . . . . . 1.062 ' O ' ' HG2' ' H' ' 187' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . . . . . . . . . 37.0 t0 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 100.81 -3.774 . . . . 50.0 100.81 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 5.1 p -52.25 145.0 11.57 Favored 'General case' 0 N--CA 1.441 -0.907 0 O-C-N 126.475 2.359 . . . . 24.26 112.966 -172.501 81.869 65.075 106.673 109.124 2.008 97.57 -66.092 -52.206 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.66 7.69 29.38 Favored Glycine 0 C--O 1.255 1.468 0 CA-C-O 114.793 -3.226 . . . . 16.5 117.39 173.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 75.8 mt -102.29 107.8 18.96 Favored 'General case' 0 C--N 1.322 -0.617 1 CA-C-O 111.172 -4.251 . . . . 17.27 103.47 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -74.4 139.17 74.85 Favored Pre-proline 0 C--O 1.245 0.857 1 O-C-N 129.947 4.529 . . . . 16.54 111.034 -178.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . 0.544 ' HA ' ' HG3' ' L' ' 9' ' ' LYS 0.305 12.3 Cg_exo -64.29 -37.55 39.81 Favored 'Trans proline' 0 C--O 1.254 1.319 0 O-C-N 118.842 -1.188 . . . . 23.3 113.634 -178.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.59 -2.25 54.4 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 118.472 -2.642 . . . . 20.37 111.604 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -123.46 -88.03 0.62 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.679 1.581 . . . . 19.27 107.412 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -51.2 -54.22 27.66 Favored 'General case' 0 C--O 1.253 1.283 0 CA-C-O 117.745 -1.121 . . . . 20.24 113.037 -177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.544 ' HG3' ' HA ' ' L' ' 5' ' ' PRO . 25.6 mmtp -51.18 -29.0 12.6 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 126.034 1.733 . . . . 36.45 115.235 178.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 41.2 mtpt -113.1 5.71 17.24 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 107.735 -1.209 . . . . 31.18 107.735 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 8.8 t 58.17 46.08 16.5 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 113.839 -1.528 . . . . 28.62 113.4 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 51.5 mt -114.08 146.16 40.62 Favored 'General case' 0 C--O 1.254 1.316 0 N-CA-C 105.848 -1.908 . . . . 25.64 105.848 174.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -100.93 146.59 27.17 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-O 114.369 -2.729 . . . . 41.68 107.531 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -83.94 167.15 17.22 Favored 'General case' 0 C--O 1.25 1.091 1 CA-C-O 128.995 4.236 . . . . 20.5 104.514 173.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . . . . . . . . 0.285 0.0 OUTLIER -67.49 -12.23 59.82 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-N 109.738 -3.392 . . . . 49.08 116.689 -171.312 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 54.1 p -135.75 0.18 2.66 Favored 'General case' 0 C--O 1.25 1.096 0 CA-C-N 122.922 2.601 . . . . 24.4 110.778 179.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . 0.458 ' O ' ' HB2' ' L' ' 14' F LEU . 11.0 pt-20 -49.45 -43.33 44.79 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 128.633 3.708 . . . . 20.88 109.403 178.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.498 ' CZ ' ' OE2' ' L' ' 14' H GLU . 0.0 OUTLIER -40.6 -45.69 2.38 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 123.433 2.833 . . . . 50.0 113.548 178.43 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 15.1 tt0 -60.07 -39.51 86.3 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 128.172 2.589 . . . . 37.64 108.915 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . 0.458 ' HB2' ' O ' ' L' ' 14' C GLU . 3.9 mp -59.5 -57.45 12.9 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 119.765 -1.834 . . . . 22.29 112.16 171.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . . . . . . . . . 1.8 mm? -64.52 -33.66 76.42 Favored 'General case' 0 C--N 1.316 -0.85 1 CA-C-O 128.763 4.125 . . . . 28.57 111.564 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.498 ' OE2' ' CZ ' ' L' ' 14' D ARG . 95.8 mt-10 -68.13 -25.09 65.12 Favored 'General case' 0 C--N 1.305 -1.344 1 O-C-N 115.681 -4.387 . . . . 35.24 105.509 179.466 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.499 ' C ' ' H ' ' L' ' 14' K ILE . 76.0 p -85.47 -12.83 50.91 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 114.945 -2.455 . . . . 29.54 115.699 178.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 0.561 ' C ' HG12 ' L' ' 14' K ILE . 7.1 m-85 -91.64 48.72 1.49 Allowed 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 102.336 -3.209 . . . . 33.21 102.336 -179.339 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . 0.561 HG12 ' C ' ' L' ' 14' J TYR 0.343 0.2 OUTLIER . . . . . 0 C--O 1.259 1.576 1 CA-C-N 107.899 -4.228 . . . . 48.91 107.523 -171.968 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.49 ' HA ' ' O ' ' H' ' 189' ' ' ASP . 10.5 mm . . . . . 0 N--CA 1.434 -1.237 0 N-CA-C 102.315 -3.217 . . . . 20.74 102.315 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.894 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 73.8 t -109.2 121.29 62.02 Favored 'Isoleucine or valine' 0 C--O 1.265 1.921 0 C-N-CA 130.505 3.522 . . . . 28.27 106.406 176.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.734 ' HG3' ' HB2' ' H' ' 187' ' ' ARG . 77.4 mm-40 72.62 32.89 1.45 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.719 1.887 . . . . 45.72 114.157 -178.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.55 -175.06 29.76 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 125.697 2.832 . . . . 30.8 109.175 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 56.3 p -129.52 166.89 18.75 Favored 'General case' 0 C--O 1.254 1.323 0 N-CA-C 103.027 -2.953 . . . . 36.88 103.027 177.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -64.84 133.1 51.21 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 128.35 3.531 . . . . 35.08 109.134 179.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.97 152.86 43.96 Favored 'General case' 0 C--O 1.244 0.785 0 N-CA-C 105.847 -1.908 . . . . 26.85 105.847 175.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -78.44 165.28 23.96 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 126.702 2.001 . . . . 30.92 108.318 170.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.4 mm -68.94 147.61 12.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 119.256 -2.152 . . . . 24.61 107.007 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 52.59 22.19 10.81 Favored Glycine 0 N--CA 1.439 -1.119 0 C-N-CA 128.217 2.818 . . . . 19.33 117.393 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 6.2 ttt -70.7 -33.31 70.76 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 122.054 2.927 . . . . 20.5 114.745 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.325 0.6 OUTLIER -133.75 67.46 74.76 Favored Pre-proline 0 C--N 1.297 -1.705 0 C-N-CA 129.558 3.143 . . . . 24.26 112.225 -178.768 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -70.98 -5.51 17.12 Favored 'Trans proline' 0 C--N 1.284 -2.832 0 O-C-N 123.781 1.411 . . . . 16.92 113.344 -172.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 5.8 p90 -94.11 -4.72 48.75 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 116.974 -1.489 . . . . 13.49 109.257 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -68.72 128.32 36.24 Favored 'General case' 0 C--O 1.263 1.789 0 CA-C-N 121.066 1.757 . . . . 21.32 110.443 -176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 69.4 t -116.93 148.17 19.83 Favored 'Isoleucine or valine' 0 C--O 1.252 1.23 0 O-C-N 121.801 -0.562 . . . . 18.58 110.276 179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . 0.412 ' HG3' HD12 ' H' ' 40' ' ' LEU . 42.8 ttm -106.48 126.33 52.13 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 106.419 -1.697 . . . . 23.18 106.419 176.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . 0.404 HD23 ' HA ' ' H' ' 33' ' ' LEU . 0.8 OUTLIER -84.63 113.2 21.1 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 106.874 -1.528 . . . . 28.6 106.874 172.514 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -125.32 133.68 52.51 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-O 127.305 3.431 . . . . 28.74 110.921 -173.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.801 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 25.9 ttt180 -77.23 122.77 25.52 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 109.435 -3.53 . . . . 38.7 111.316 175.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.696 ' HE2' ' O ' ' H' ' 513' ' ' HOH . 12.1 mttt -57.9 -52.2 66.46 Favored 'General case' 0 C--O 1.258 1.536 0 CA-C-N 113.529 -1.669 . . . . 39.99 112.625 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.2 OUTLIER -152.34 117.79 3.02 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 124.911 1.382 . . . . 47.76 113.868 -179.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . 0.531 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 8.4 Cg_endo -70.34 133.19 25.59 Favored 'Cis proline' 0 C--N 1.32 -0.97 0 N-CA-C 106.151 -2.288 . . . . 42.39 106.151 -1.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.801 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 41.1 mt-30 -52.37 116.42 2.24 Favored 'General case' 0 C--N 1.29 -2.006 0 C-N-CA 130.46 3.504 . . . . 50.0 107.27 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' H' ' 37' ' ' PRO . 17.8 pt-20 -166.61 154.48 9.89 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 126.981 2.676 . . . . 47.62 112.019 -178.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . 0.412 HD12 ' HG3' ' H' ' 32' ' ' MET . 3.7 tp -73.48 120.31 18.91 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 106.14 -1.8 . . . . 34.91 106.14 -178.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.423 HD23 HD22 ' H' ' 64' ' ' LEU . 0.0 OUTLIER -88.83 -56.33 3.34 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 127.833 3.208 . . . . 28.34 109.994 175.028 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . 0.288 4.6 m -164.59 -177.16 4.66 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 118.848 -2.407 . . . . 21.24 105.946 -175.174 -86.582 -164.453 -96.651 104.828 2.0 108.431 -83.191 -75.591 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -101.26 175.05 25.61 Favored Glycine 0 C--O 1.27 2.383 0 N-CA-C 105.127 -3.189 . . . . 17.37 105.127 173.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -165.42 -179.06 5.29 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 101.358 -3.571 . . . . 11.15 101.358 -179.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 32.4 p -141.39 147.37 37.9 Favored 'General case' 0 C--N 1.314 -0.958 0 O-C-N 126.311 2.257 . . . . 15.02 110.375 176.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . 0.843 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -85.67 128.01 34.66 Favored 'General case' 0 C--O 1.248 0.988 0 N-CA-C 105.997 -1.853 . . . . 19.34 105.997 179.249 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.18 -14.85 10.7 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 125.397 1.479 . . . . 18.16 112.297 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . 0.843 ' O ' HD22 ' H' ' 46' ' ' LEU . 58.4 p -166.34 176.09 7.74 Favored 'General case' 0 C--O 1.273 2.316 0 CA-C-O 116.549 -1.691 . . . . 28.02 108.004 174.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -62.5 -15.37 49.83 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 113.93 -2.938 . . . . 35.92 115.701 -178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 1.061 ' HG2' HH11 ' H' ' 50' ' ' ARG 0.283 0.0 OUTLIER -124.2 -8.69 7.62 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 114.697 -2.573 . . . . 49.01 112.885 -178.057 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -119.79 130.37 54.9 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 120.42 1.464 . . . . 24.46 113.54 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . 0.505 HG21 HD21 ' H' ' 108' ' ' LEU . 66.1 t -120.59 139.38 48.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 115.321 -2.276 . . . . 22.41 109.072 -178.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 27.3 tp -115.52 137.87 51.62 Favored 'General case' 0 C--N 1.322 -0.602 0 O-C-N 125.025 1.453 . . . . 20.79 112.847 179.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 6.0 t -155.98 175.86 13.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 C-N-CA 124.797 1.239 . . . . 18.32 111.939 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.93 136.45 37.26 Favored 'General case' 0 C--O 1.266 1.951 0 N-CA-C 107.71 -1.218 . . . . 16.88 107.71 -179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.3 -29.26 69.76 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 115.12 -2.371 . . . . 16.83 112.681 177.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -72.75 -9.21 58.38 Favored 'General case' 0 C--O 1.255 1.355 0 CA-C-N 120.489 1.495 . . . . 24.33 111.152 -172.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 55.0 m -73.74 -30.9 63.07 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 126.148 2.155 . . . . 24.17 109.791 175.812 -75.591 -83.191 -96.651 108.431 2.0 104.828 -164.453 -86.582 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 61.8 mt -98.49 -46.16 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 O-C-N 120.899 -1.125 . . . . 25.24 111.776 -176.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 51.7 tp -128.08 110.3 12.35 Favored 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.141 1.776 . . . . 27.73 113.734 -175.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 39.3 t80 -149.23 83.2 6.68 Favored Pre-proline 0 CA--C 1.543 0.705 0 CA-C-N 113.989 -1.46 . . . . 27.95 110.222 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . . . . . . . . 0.287 23.3 Cg_exo -50.67 -34.41 43.55 Favored 'Trans proline' 0 CA--C 1.495 -1.459 0 C-N-CA 124.456 3.437 . . . . 28.97 117.726 -178.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . . . . . . . . . 4.5 Cg_exo -64.0 -14.59 44.31 Favored 'Trans proline' 0 C--N 1.305 -1.762 0 CA-C-N 122.96 2.093 . . . . 32.2 112.514 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . . . . . . . . . 45.8 m0 -121.34 18.31 11.43 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 106.071 -1.825 . . . . 42.33 106.071 -176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . . 11.9 m-20 54.63 35.85 24.67 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 114.352 -2.939 . . . . 45.89 113.111 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . 0.73 ' HE2' ' O ' ' H' ' 527' ' ' HOH . 30.7 ttmt -103.39 113.71 27.42 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 123.235 1.493 . . . . 33.91 107.94 175.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . . . . . . . . . 59.1 t-20 -151.37 82.02 1.3 Allowed 'General case' 0 C--O 1.252 1.2 0 CA-C-N 112.76 -2.018 . . . . 39.76 109.653 174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 25.6 m-85 -81.1 132.44 35.36 Favored 'General case' 0 C--O 1.242 0.676 0 C-N-CA 125.473 1.509 . . . . 33.17 114.356 177.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.466 ' HB ' ' OD2' ' H' ' 63' ' ' ASP 0.279 0.8 OUTLIER -98.07 165.68 11.79 Favored 'General case' 0 C--O 1.248 0.997 0 CA-C-O 126.15 2.881 . . . . 35.55 111.888 174.134 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . 0.77 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.2 OUTLIER -50.3 -48.8 54.93 Favored 'General case' 0 C--O 1.268 2.07 1 O-C-N 115.497 -4.502 . . . . 47.58 115.323 175.854 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . 0.491 ' O ' ' HE3' ' H' ' 36' ' ' LYS . 6.1 m-20 -59.22 -24.27 63.01 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 113.796 -1.547 . . . . 50.0 113.535 177.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.466 ' OD2' ' HB ' ' H' ' 60' I THR . 9.2 m-20 -77.91 -12.93 60.02 Favored 'General case' 0 C--O 1.256 1.432 0 CA-C-O 112.2 -3.762 . . . . 44.79 114.373 -175.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.423 HD22 HD23 ' H' ' 41' ' ' LEU . 0.3 OUTLIER -138.45 169.27 18.08 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 128.353 3.533 . . . . 30.41 115.734 -173.907 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . 0.508 HD22 ' HG2' ' H' ' 36' ' ' LYS . 0.0 OUTLIER -124.65 150.28 46.24 Favored 'General case' 0 C--N 1.301 -1.505 1 CA-C-N 107.881 -4.236 . . . . 26.67 109.746 172.141 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . 0.331 0.9 OUTLIER -114.71 121.46 66.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 CA-C-O 125.853 2.739 . . . . 25.22 107.954 171.387 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . 0.412 ' HB2' ' HB3' ' H' ' 32' ' ' MET . 76.6 mtp180 -111.38 112.67 24.59 Favored 'General case' 0 C--O 1.252 1.2 0 O-C-N 116.856 -3.652 . . . . 21.83 112.681 177.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 1.6 mt -110.2 137.6 41.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.669 0 C-N-CA 127.426 2.29 . . . . 22.03 115.101 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.65 17.55 48.39 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 124.957 1.265 . . . . 17.81 114.141 177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.549 ' HE3' ' O ' ' H' ' 72' ' ' SER . 19.3 mtpp -81.78 159.18 23.87 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.138 0.97 . . . . 19.66 113.551 -178.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.413 ' CD2' HG22 ' H' ' 154' ' ' VAL . 52.7 t60 -135.2 -57.46 0.8 Allowed 'General case' 0 C--O 1.259 1.58 0 C-N-CA 128.992 2.917 . . . . 24.07 105.017 179.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.71 ' OG ' ' HG2' ' H' ' 75' ' ' ARG . 33.1 t -69.92 136.43 50.58 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 111.014 -2.812 . . . . 24.04 108.53 177.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 52.0 ttp85 -69.72 -47.68 62.24 Favored 'General case' 0 C--O 1.258 1.531 0 C-N-CA 123.76 0.824 . . . . 35.97 111.734 176.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 20.2 p -109.08 -13.86 14.63 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 119.931 3.308 . . . . 28.74 119.931 -177.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 0.879 ' HG3' HH11 ' H' ' 75' ' ' ARG . 0.1 OUTLIER -75.97 157.66 32.86 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 121.202 1.819 . . . . 44.15 113.476 173.139 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -97.07 98.61 10.2 Favored 'General case' 0 C--O 1.258 1.545 0 N-CA-C 103.234 -2.876 . . . . 34.22 103.234 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -82.02 82.47 7.6 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 127.435 3.493 . . . . 27.14 112.521 -171.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.568 ' O ' ' O ' ' H' ' 404' ' ' HOH . 18.0 ttp85 -53.94 126.71 23.44 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 128.908 2.883 . . . . 27.73 107.869 -179.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' H' ' 77' A ARG . 8.2 m120 75.83 -12.94 0.93 Allowed 'General case' 0 C--O 1.255 1.343 0 CA-C-N 109.823 -3.353 . . . . 31.93 112.62 -177.711 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -99.81 -56.39 5.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.46 0 O-C-N 118.945 -2.347 . . . . 23.68 111.588 -178.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . 0.572 ' O ' ' HD2' ' H' ' 81' ' ' LYS . 4.4 pt-20 -82.8 147.73 28.21 Favored 'General case' 0 CA--C 1.508 -0.669 0 O-C-N 127.106 2.754 . . . . 24.47 114.7 -175.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' H' ' 80' ' ' GLU . 8.2 mptt -120.29 129.2 53.91 Favored 'General case' 0 C--N 1.303 -1.413 0 C-N-CA 128.676 2.79 . . . . 42.46 105.085 175.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 84.2 mt -110.15 125.69 67.38 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.698 0 CA-C-O 113.066 -3.35 . . . . 28.18 107.269 -178.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -131.06 173.87 10.58 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 125.468 2.556 . . . . 37.31 110.09 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . 0.523 ' HE1' ' O ' ' H' ' 513' ' ' HOH . 0.5 OUTLIER -114.61 142.56 46.28 Favored 'General case' 0 C--N 1.314 -0.951 1 CA-C-N 107.181 -4.554 . . . . 40.75 105.663 -177.403 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.928 HD13 ' HE2' ' H' ' 106' ' ' MET . 22.1 mt -88.42 139.52 30.41 Favored 'General case' 0 C--N 1.32 -0.706 1 O-C-N 130.89 5.119 . . . . 34.69 109.216 -179.219 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . 0.453 ' OE1' ' NH2' ' H' ' 50' ' ' ARG . 30.2 tt0 -94.68 -35.75 12.04 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 104.94 -2.245 . . . . 45.85 104.94 178.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.77 ' HA ' ' OE1' ' H' ' 61' ' ' GLU . 2.2 tmtt? -163.85 145.87 9.25 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 116.053 -2.259 . . . . 41.41 112.076 -176.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.628 ' H ' ' HD3' ' H' ' 87' ' ' LYS . 62.1 mt -114.83 130.81 68.65 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 O-C-N 127.601 3.063 . . . . 29.59 111.809 177.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -122.69 127.53 49.39 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 116.188 -1.863 . . . . 39.58 109.888 174.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -105.57 150.56 8.18 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 C-N-CA 126.497 1.919 . . . . 23.49 109.188 177.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -64.42 130.57 94.73 Favored Pre-proline 0 C--O 1.254 1.298 0 CA-C-N 122.419 2.372 . . . . 21.31 107.95 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -55.55 -30.93 76.59 Favored 'Trans proline' 0 C--N 1.318 -1.058 0 C-N-CA 122.213 1.942 . . . . 27.37 111.71 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -109.36 26.82 10.19 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-N 121.306 1.866 . . . . 45.32 114.019 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . 0.286 2.4 t80 -53.06 137.6 32.94 Favored 'General case' 0 C--N 1.299 -1.607 0 CA-C-O 114.81 -2.519 . . . . 22.4 108.387 174.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -113.44 89.99 3.23 Favored 'General case' 0 C--N 1.304 -1.38 1 CA-C-N 126.966 4.439 . . . . 28.82 110.64 -178.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 46.2 p-90 -86.32 -13.61 46.06 Favored 'General case' 0 C--O 1.26 1.645 0 CA-C-O 115.817 -2.04 . . . . 28.47 108.512 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 43.8 mtt-85 -77.96 -40.5 39.17 Favored 'General case' 0 C--O 1.241 0.614 0 O-C-N 126.283 2.239 . . . . 38.01 113.698 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . . . . . . . . . 8.1 tt0 -106.25 -62.28 1.4 Allowed 'General case' 0 C--O 1.251 1.134 0 CA-C-O 113.209 -3.282 . . . . 42.72 113.322 -176.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' H' ' 99' ' ' LEU . 33.2 p30 -138.04 12.77 2.87 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 115.42 -2.229 . . . . 27.22 114.521 -174.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' H' ' 98' ' ' ASN . 10.6 mt 65.65 37.48 5.83 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 123.902 3.046 . . . . 29.74 112.564 -175.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -72.22 136.71 46.45 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 112.47 -3.633 . . . . 25.36 103.27 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 70.1 mtt85 66.25 35.95 5.69 Favored 'General case' 0 C--N 1.314 -0.939 1 O-C-N 131.662 5.601 . . . . 27.82 112.873 -179.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -67.61 82.99 0.17 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 116.591 -1.671 . . . . 13.38 107.13 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.496 HD11 HD11 ' H' ' 238' ' ' ILE . 7.1 tt -150.44 147.56 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 CA-C-O 116.088 -1.911 . . . . 15.98 108.675 -178.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -154.77 146.11 22.97 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 108.11 -1.07 . . . . 19.5 108.11 177.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -108.47 145.53 34.52 Favored 'General case' 0 C--O 1.258 1.522 0 C-N-CA 125.401 1.48 . . . . 24.96 108.075 173.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.928 ' HE2' HD13 ' H' ' 85' ' ' LEU . 39.2 mtp -123.14 126.45 47.04 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-O 114.756 -2.545 . . . . 32.02 106.582 179.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . 0.756 ' NZ ' ' NE ' ' H' ' 50' ' ' ARG . 41.5 tttp -94.58 123.27 37.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 113.069 -3.348 . . . . 41.0 106.105 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . 0.505 HD21 HG21 ' H' ' 52' ' ' VAL . 33.8 mt -77.72 144.67 37.07 Favored 'General case' 0 N--CA 1.5 2.057 1 O-C-N 130.758 5.036 . . . . 28.05 108.875 -177.969 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . 0.45 ' HA ' ' HB2' ' H' ' 86' ' ' GLU . 3.5 tptm -60.9 -25.73 66.94 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-N 121.205 1.82 . . . . 48.37 107.719 178.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -158.18 149.44 16.61 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 119.575 -1.953 . . . . 50.0 109.648 176.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.21 146.54 95.92 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 O-C-N 126.327 2.751 . . . . 32.93 110.069 -175.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . 0.306 4.4 p -99.13 146.52 8.34 Favored 'Isoleucine or valine' 0 C--O 1.252 1.217 1 CA-C-N 106.798 -4.728 . . . . 29.84 105.416 178.682 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -94.02 134.65 36.21 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 111.343 -2.662 . . . . 25.94 108.39 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . 0.456 ' HD1' ' HA ' ' H' ' 114' ' ' PHE . 22.2 m-30 -64.17 156.96 26.9 Favored 'General case' 0 C--O 1.254 1.338 0 C-N-CA 130.042 3.337 . . . . 22.88 107.438 176.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 4.3 p -170.4 -169.04 0.77 Allowed 'General case' 0 N--CA 1.487 1.379 1 O-C-N 130.425 4.828 . . . . 22.57 104.512 -178.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 63.5 m-20 -64.01 -29.87 70.99 Favored 'General case' 0 C--N 1.292 -1.901 0 CA-C-O 115.379 -2.248 . . . . 28.95 110.826 177.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -111.05 -4.3 15.15 Favored 'General case' 0 C--O 1.257 1.488 0 O-C-N 128.383 3.552 . . . . 27.81 115.858 -170.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 52.2 mt -131.62 113.91 24.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.775 1 O-C-N 131.113 5.258 . . . . 18.24 110.688 -176.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . 0.406 ' HA ' ' HD3' ' H' ' 120' ' ' PRO . 23.1 t60 -169.16 139.71 1.86 Allowed Pre-proline 0 C--O 1.258 1.523 1 O-C-N 130.606 4.942 . . . . 21.4 109.568 -174.015 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' H' ' 119' ' ' HIS . 4.6 Cg_endo -82.53 158.1 16.7 Favored 'Trans proline' 0 C--O 1.258 1.504 0 C-N-CA 122.91 2.406 . . . . 15.57 114.788 -175.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 8.1 p -98.35 157.77 3.52 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-N 109.29 -3.596 . . . . 14.88 105.309 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 38.7 m -92.44 153.07 19.35 Favored 'General case' 0 C--O 1.205 -1.277 0 O-C-N 125.431 1.707 . . . . 15.07 108.563 179.015 -52.206 -66.092 106.673 97.57 2.008 109.124 65.075 81.869 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' H' ' 124' ' ' PRO . 52.9 mt -102.75 133.56 20.36 Favored Pre-proline 0 C--N 1.287 -2.118 0 N-CA-C 102.222 -3.251 . . . . 15.09 102.222 175.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' H' ' 123' ' ' LEU . 9.5 Cg_endo -67.48 151.87 79.4 Favored 'Trans proline' 0 C--O 1.243 0.744 0 O-C-N 127.976 3.619 . . . . 21.0 106.337 -174.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -111.81 157.27 20.76 Favored 'General case' 0 C--O 1.26 1.652 0 N-CA-C 102.072 -3.307 . . . . 37.65 102.072 172.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . 0.408 ' NE ' ' O ' ' H' ' 466' ' ' HOH . 29.2 ttt180 -38.87 -37.85 0.38 Allowed 'General case' 0 C--O 1.246 0.893 0 N-CA-C 119.887 3.291 . . . . 50.0 119.887 -178.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . 0.26 0.9 OUTLIER -82.08 -27.55 32.84 Favored 'General case' 0 C--O 1.276 2.455 0 C-N-CA 117.871 -1.532 . . . . 45.72 111.992 -178.103 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 31.1 m -65.1 -52.83 53.17 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 106.976 -1.49 . . . . 33.53 106.976 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.63 -46.61 86.72 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-O 121.719 0.771 . . . . 25.39 109.338 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -54.06 -47.8 71.28 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-O 116.003 -1.951 . . . . 26.19 109.701 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 0.7 OUTLIER -74.8 -36.88 62.47 Favored 'General case' 0 C--O 1.255 1.345 1 CA-C-O 111.678 -4.01 . . . . 32.6 117.548 -177.918 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . 0.474 HD21 ' CD ' ' H' ' 204' ' ' PRO . 29.9 mt -95.94 -28.67 14.56 Favored 'General case' 0 C--O 1.259 1.57 0 O-C-N 126.077 2.111 . . . . 25.07 115.457 -175.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.49 78.49 1.05 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 115.805 -2.358 . . . . 22.51 108.952 179.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -129.01 140.56 51.59 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-O 123.432 1.586 . . . . 45.04 113.3 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.87 134.93 55.78 Favored 'General case' 0 C--O 1.253 1.266 1 CA-C-O 106.798 -6.334 . . . . 22.54 102.403 -176.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 104.72 -44.9 1.38 Allowed Glycine 0 CA--C 1.54 1.628 1 O-C-N 136.387 8.555 . . . . 19.63 115.692 -177.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . 0.439 ' O ' HG13 ' H' ' 162' ' ' ILE . 2.7 m-30 -63.67 129.69 41.2 Favored 'General case' 0 C--O 1.266 1.964 0 C-N-CA 125.168 1.387 . . . . 24.75 107.963 179.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 59.2 mttt -84.65 144.61 28.47 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-O 112.682 -3.532 . . . . 20.73 117.056 178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . 0.453 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -126.44 179.63 16.21 Favored Glycine 0 CA--C 1.549 2.199 1 O-C-N 129.236 4.085 . . . . 10.01 104.785 174.489 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 43.3 ttm180 -127.41 134.8 49.86 Favored 'General case' 0 C--O 1.268 2.031 0 C-N-CA 125.597 1.559 . . . . 16.32 111.297 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 21.9 t -118.95 139.88 44.77 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 126.437 1.895 . . . . 16.8 106.866 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 0.743 HG22 HG22 ' H' ' 157' ' ' VAL . 16.9 p -133.84 153.28 51.85 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 113.688 -3.053 . . . . 15.37 109.24 -179.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.15 37.37 Favored Glycine 0 N--CA 1.488 2.122 0 C-N-CA 115.087 -3.435 . . . . 16.98 107.325 177.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 18.1 m-90 -108.48 22.77 15.48 Favored 'General case' 0 C--N 1.347 0.489 0 O-C-N 127.157 2.328 . . . . 25.82 108.212 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -78.21 -177.59 48.25 Favored Glycine 0 CA--C 1.528 0.879 0 CA-C-O 125.553 2.752 . . . . 26.98 110.11 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' H' ' 150' ' ' GLY . 59.8 m-20 -50.01 138.08 16.15 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 110.507 -2.846 . . . . 36.05 109.397 179.018 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . 0.443 HD11 ' HA ' ' H' ' 152' ' ' PRO . 96.5 mt -89.04 -6.88 56.84 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 108.41 -3.996 . . . . 36.28 110.338 177.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -150.74 140.39 21.66 Favored 'General case' 0 C--O 1.258 1.531 0 O-C-N 127.785 3.178 . . . . 50.0 111.275 -171.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . 0.713 ' HB2' ' O ' ' H' ' 519' ' ' HOH 0.26 27.6 tt0 . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 125.578 2.608 . . . . 48.6 107.881 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . 0.4 ' O ' ' HA ' ' H' ' 143' ' ' ASN . . . . . . . . 0 C--O 1.249 1.088 0 N-CA-C 116.561 1.385 . . . . 43.45 116.561 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -126.25 122.16 24.0 Favored Pre-proline 0 C--N 1.309 -1.187 0 C-N-CA 128.003 2.521 . . . . 50.0 106.738 178.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . 0.443 ' HA ' HD11 ' H' ' 144' ' ' LEU . 1.0 OUTLIER -66.08 163.55 31.0 Favored 'Trans proline' 0 C--N 1.322 -0.848 0 O-C-N 125.611 2.374 . . . . 36.1 108.5 -174.362 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.74 -25.87 15.91 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 114.016 -3.074 . . . . 38.53 106.066 173.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.413 HG22 ' CD2' ' H' ' 71' ' ' HIS 0.372 0.4 OUTLIER -135.67 156.68 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 CA-C-O 115.0 -2.428 . . . . 25.88 110.591 -175.65 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 45.1 tp -45.83 123.11 4.17 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 130.473 3.509 . . . . 20.7 107.353 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.46 ' C ' HG23 ' H' ' 157' ' ' VAL . 13.2 mm100 -102.59 166.56 10.45 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.476 1.11 . . . . 25.85 111.49 -177.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 0.743 HG22 HG22 ' H' ' 139' ' ' THR . 12.5 t -144.17 155.27 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 114.73 -2.557 . . . . 24.15 111.451 177.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -153.46 142.86 14.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-O 113.37 -3.205 . . . . 19.19 109.185 171.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -99.65 132.77 44.77 Favored 'General case' 0 C--O 1.27 2.152 0 C-N-CA 128.833 2.853 . . . . 20.4 106.456 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 16.7 mt -142.05 147.31 43.86 Favored Pre-proline 0 C--N 1.304 -1.37 0 O-C-N 124.328 1.018 . . . . 22.42 109.663 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . 0.409 ' HD3' ' CZ ' ' H' ' 184' A TYR . 5.1 Cg_endo -79.09 138.69 14.55 Favored 'Trans proline' 0 C--N 1.305 -1.723 0 CA-C-O 113.106 -2.956 . . . . 18.22 115.943 179.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . 0.439 HG13 ' O ' ' H' ' 134' ' ' TYR . 3.6 mt -69.91 133.72 31.37 Favored 'Isoleucine or valine' 0 C--O 1.287 3.039 0 CA-C-N 121.202 1.819 . . . . 20.82 110.761 168.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 48.5 t -103.3 152.32 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.751 0 C-N-CA 118.413 -1.315 . . . . 18.41 109.288 -176.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -60.12 131.69 51.61 Favored 'General case' 0 C--N 1.293 -1.866 1 C-N-CA 131.846 4.058 . . . . 44.27 107.987 -179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.597 ' CD ' ' O ' ' H' ' 422' ' ' HOH . 6.0 ttt85 -35.95 -50.96 1.61 Allowed Pre-proline 0 C--N 1.301 -1.507 0 C-N-CA 127.404 2.281 . . . . 48.84 116.911 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' H' ' 165' ' ' ARG . 6.1 Cg_exo -64.8 -49.04 3.32 Favored 'Trans proline' 0 C--O 1.259 1.53 0 C-N-CA 124.701 3.601 . . . . 27.58 112.196 -177.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . 0.508 HG11 ' HE2' ' H' ' 185' ' ' LYS . 19.2 t -52.2 -40.33 30.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 C-N-CA 119.387 -0.925 . . . . 26.06 108.67 174.917 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 59.5 m -61.14 -51.72 67.9 Favored 'General case' 0 C--O 1.269 2.1 0 O-C-N 121.135 -0.978 . . . . 23.75 108.957 178.616 -55.271 -75.327 -82.553 102.021 2.008 106.2 -86.306 86.989 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . . 3.4 mtpp -55.54 -42.82 75.14 Favored 'General case' 0 C--O 1.26 1.65 0 CA-C-O 125.899 2.761 . . . . 37.53 118.074 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -69.03 -12.21 61.48 Favored 'General case' 0 C--N 1.281 -2.371 1 C-N-CA 134.607 5.163 . . . . 25.28 114.312 179.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 87.2 p -93.12 -15.77 25.67 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 113.891 -2.957 . . . . 25.86 108.472 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 7.0 t -139.84 175.65 9.4 Favored 'General case' 0 C--O 1.25 1.123 1 O-C-N 130.529 4.893 . . . . 27.67 115.418 -177.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 15.9 mtp180 -102.13 -8.63 21.22 Favored 'General case' 0 C--O 1.25 1.105 0 O-C-N 119.047 -2.283 . . . . 35.56 108.98 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 87.8 mt -76.64 135.56 26.46 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 O-C-N 128.092 3.37 . . . . 33.81 111.745 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 64.8 ttp85 -70.0 103.59 2.31 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-N 112.885 -1.961 . . . . 41.96 111.558 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . 0.851 HD12 ' CE2' ' H' ' 227' ' ' PHE . 4.4 mm -81.18 127.72 39.32 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 C-N-CA 129.505 3.122 . . . . 29.56 112.171 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . 0.535 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.7 p -103.73 177.98 4.69 Favored 'General case' 0 C--N 1.312 -1.061 0 O-C-N 118.852 -2.405 . . . . 24.64 109.444 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 -70.4 -19.49 63.0 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 128.387 2.675 . . . . 24.94 111.629 174.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 -85.57 20.2 2.17 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 121.168 1.804 . . . . 19.79 108.59 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 42.4 mtt -133.8 163.38 29.6 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 114.152 -2.832 . . . . 20.26 108.575 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . 0.28 12.2 p90 -154.65 151.8 29.22 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 101.97 -3.344 . . . . 13.1 101.97 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 1.5 p -117.66 163.46 16.43 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 115.989 -2.284 . . . . 22.86 105.909 179.81 86.989 -86.306 -82.553 106.2 2.008 102.021 -75.327 -55.271 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -151.25 148.81 28.66 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 125.884 1.99 . . . . 16.71 106.157 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 149.56 171.54 18.22 Favored Glycine 0 C--N 1.297 -1.583 0 C-N-CA 129.601 3.477 . . . . 18.89 108.793 -175.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . 0.409 ' CZ ' ' HD3' ' H' ' 161' ' ' PRO . 47.1 m-85 -87.78 139.16 30.81 Favored 'General case' 0 C--O 1.269 2.12 0 C-N-CA 130.282 3.433 . . . . 25.97 111.121 178.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.663 ' H ' ' HG3' ' H' ' 186' B GLU . 21.1 mmtp -70.29 154.55 94.43 Favored Pre-proline 0 C--O 1.26 1.616 0 N-CA-C 104.499 -2.408 . . . . 34.1 104.499 175.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . 0.44 ' HB3' ' HB3' ' H' ' 222' ' ' ASP . 1.1 Cg_endo -65.51 -17.63 57.77 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 N-CA-C 107.142 -1.907 . . . . 40.58 107.142 -176.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -32.83 22.51 Favored 'General case' 0 C--O 1.251 1.169 0 O-C-N 127.562 3.038 . . . . 50.0 111.329 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . 0.663 ' HG3' ' H ' ' H' ' 185' ' ' LYS . 0.9 OUTLIER -59.4 -19.01 43.81 Favored 'General case' 0 C--O 1.241 0.653 0 O-C-N 125.027 1.454 . . . . 48.48 109.123 -177.436 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 52.05 57.88 11.96 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 113.212 -1.813 . . . . 49.49 112.015 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . 0.473 ' O ' ' O ' ' H' ' 532' ' ' HOH . 0.0 OUTLIER -146.1 149.93 34.97 Favored 'General case' 0 C--O 1.248 0.978 0 N-CA-C 102.222 -3.251 . . . . 45.11 102.222 173.136 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 1.062 ' HG2' ' O ' ' H' ' 532' ' ' HOH . 8.5 mtp85 -130.94 -172.32 2.79 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 126.527 2.392 . . . . 36.1 108.637 -178.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.894 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 130.5 141.95 5.03 Favored Glycine 0 N--CA 1.475 1.291 0 N-CA-C 107.284 -2.326 . . . . 27.14 107.284 176.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' H' ' 188' ' ' GLY . 25.9 t0 -177.03 158.75 1.58 Allowed 'General case' 0 N--CA 1.479 1.003 0 O-C-N 126.245 1.791 . . . . 27.49 108.887 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.43 176.07 1.55 Allowed 'General case' 0 C--O 1.255 1.387 0 N-CA-C 101.127 -3.657 . . . . 31.82 101.127 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 14.4 t -171.54 178.4 3.18 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 104.003 -2.591 . . . . 33.6 104.003 -179.977 -166.571 60.241 84.019 104.799 2.051 101.85 -164.273 -60.742 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.18 123.61 2.51 Favored 'General case' 0 C--O 1.252 1.206 0 CA-C-O 113.012 -3.375 . . . . 50.0 107.849 -178.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 102.08 -23.79 33.35 Favored Glycine 0 C--O 1.253 1.303 1 O-C-N 129.871 4.482 . . . . 27.93 116.458 178.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -79.63 -22.92 42.99 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 113.248 0.832 . . . . 25.08 113.248 -178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.63 151.24 0.06 Allowed 'General case' 0 CA--C 1.493 -1.236 0 O-C-N 127.538 3.024 . . . . 29.62 109.106 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 74.11 -2.03 45.56 Favored Glycine 0 C--N 1.302 -1.357 0 CA-C-O 124.12 1.955 . . . . 13.54 112.774 176.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -83.09 177.94 53.09 Favored Glycine 0 C--O 1.256 1.506 1 O-C-N 115.189 -4.712 . . . . 12.25 111.298 177.923 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -87.92 146.88 6.81 Favored 'Trans proline' 0 C--N 1.344 0.31 0 CA-C-N 111.075 -2.563 . . . . 13.31 116.461 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . 0.453 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 3.9 t80 -115.71 109.69 18.06 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 100.367 -3.938 . . . . 13.98 100.367 169.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 30.5 m -119.79 157.74 21.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 1 O-C-N 115.994 -4.191 . . . . 12.64 110.385 -175.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 86.6 mtp -134.83 158.47 44.13 Favored 'General case' 0 C--O 1.255 1.372 0 CA-C-O 114.584 -2.627 . . . . 16.76 104.756 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 34.5 tttt -105.2 125.56 51.12 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 127.889 3.243 . . . . 13.27 108.65 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . 0.488 ' HB3' ' ND2' ' H' ' 204' B ASN . 28.7 t -68.89 122.85 86.55 Favored Pre-proline 0 C--O 1.264 1.839 0 CA-C-O 125.59 2.614 . . . . 19.49 112.072 177.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . 0.474 ' CD ' HD21 ' H' ' 129' C LEU . 1.8 Cg_endo -68.9 -16.0 40.78 Favored 'Trans proline' 0 N--CA 1.482 0.825 0 CA-C-N 111.615 -1.959 . . . . 22.06 111.173 178.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 54.5 m-85 -89.12 -50.06 6.38 Favored 'General case' 0 C--O 1.248 0.998 0 O-C-N 118.061 -2.899 . . . . 23.82 111.076 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.585 ' O ' ' HB2' ' H' ' 205' ' ' ASN . 0.1 OUTLIER -117.67 5.37 12.33 Favored 'General case' 0 C--O 1.252 1.228 0 C-N-CA 115.681 -2.408 . . . . 18.69 112.976 -179.423 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . 0.585 ' HB2' ' O ' ' H' ' 204' B ASN . 1.4 m120 70.14 14.13 7.71 Favored 'General case' 0 N--CA 1.485 1.316 0 N-CA-C 118.512 2.782 . . . . 34.83 118.512 179.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' H' ' 206' ' ' ARG . 32.7 mtt180 -93.64 151.66 19.52 Favored 'General case' 0 C--N 1.308 -1.206 0 O-C-N 127.371 2.92 . . . . 24.16 112.865 178.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 74.2 m95 -88.62 131.9 34.78 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 115.972 -1.966 . . . . 14.43 109.142 175.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -119.55 134.57 55.16 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 127.391 2.932 . . . . 15.13 114.7 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -77.97 110.91 13.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 125.126 3.603 . . . . 11.37 109.667 176.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 79.7 mmm -90.34 -36.59 14.57 Favored 'General case' 0 N--CA 1.484 1.233 1 O-C-N 114.8 -4.938 . . . . 20.86 111.94 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.465 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -131.75 173.69 20.45 Favored Glycine 0 C--O 1.26 1.737 0 O-C-N 119.572 -1.955 . . . . 11.91 111.768 -177.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 15.2 mt -126.1 130.37 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.512 0 CA-C-O 113.348 -3.215 . . . . 14.41 106.38 172.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . 0.418 HG13 ' O ' ' H' ' 429' ' ' HOH . 44.5 t -59.03 114.85 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 122.536 2.426 . . . . 17.01 106.371 177.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 35.8 t -110.92 -71.72 0.75 Allowed 'General case' 0 C--O 1.25 1.082 0 CA-C-O 112.62 -3.562 . . . . 24.2 111.567 -171.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 67.9 p-90 -153.74 170.5 20.76 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 122.244 2.293 . . . . 30.19 110.788 178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -163.71 175.68 39.87 Favored Glycine 0 N--CA 1.475 1.238 0 N-CA-C 109.562 -1.415 . . . . 31.67 109.562 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -122.65 95.04 4.47 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.032 -1.84 . . . . 44.47 106.032 -177.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . 0.415 ' HA3' ' NE ' ' H' ' 221' A ARG . . . 84.35 -161.78 37.64 Favored Glycine 0 N--CA 1.51 3.604 0 N-CA-C 103.975 -3.65 . . . . 33.07 103.975 -174.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 78.3 m -133.63 118.72 18.53 Favored 'General case' 0 C--O 1.274 2.372 0 C-N-CA 125.542 1.537 . . . . 38.22 109.321 177.748 -60.742 -164.273 84.019 101.85 2.051 104.799 60.241 -166.571 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . 0.511 ' O ' ' NH2' ' H' ' 187' ' ' ARG . 18.5 t0 58.21 41.0 24.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 117.347 -1.741 . . . . 37.63 111.359 176.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . 0.599 ' HE ' ' CD ' ' H' ' 146' ' ' GLU . 5.7 mmt85 -83.84 144.37 29.3 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 127.499 2.999 . . . . 42.5 107.046 175.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' H' ' 186' ' ' PRO . 14.7 m-20 -72.75 144.28 47.66 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 123.916 3.053 . . . . 46.86 109.166 179.085 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 68.42 13.42 65.24 Favored Glycine 0 C--O 1.25 1.133 0 CA-C-O 114.829 -3.206 . . . . 34.72 110.385 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . 1.187 ' HG3' ' O ' ' H' ' 514' ' ' HOH . 12.3 mmtt -119.72 157.54 28.34 Favored 'General case' 0 C--O 1.269 2.117 0 CA-C-N 122.188 2.994 . . . . 43.75 103.874 172.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -129.99 167.92 17.5 Favored 'General case' 0 C--O 1.251 1.168 0 N-CA-C 114.526 1.306 . . . . 27.31 114.526 -176.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.476 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -92.22 143.82 16.75 Favored Glycine 0 CA--C 1.54 1.635 0 CA-C-O 114.422 -3.432 . . . . 20.41 107.174 176.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . 0.851 ' CE2' HD12 ' H' ' 176' ' ' ILE . 38.8 m-85 -107.76 136.62 47.19 Favored 'General case' 0 C--O 1.258 1.528 1 O-C-N 130.806 4.474 . . . . 22.92 107.268 178.269 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -129.82 140.67 50.97 Favored 'General case' 0 C--O 1.259 1.569 0 O-C-N 126.458 2.349 . . . . 13.58 111.806 -175.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.465 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 4.8 m -70.14 133.64 47.33 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 123.73 1.729 . . . . 14.77 107.683 175.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -77.92 92.63 4.31 Favored 'General case' 0 C--N 1.299 -1.612 0 O-C-N 119.389 -2.069 . . . . 19.14 111.199 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 30.2 t -54.22 -48.54 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.063 0 O-C-N 120.107 -1.62 . . . . 17.69 108.31 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -60.04 -46.23 90.22 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 122.982 2.628 . . . . 21.8 113.035 -178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 9.8 mtp-105 -57.77 -23.87 54.4 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 113.302 -3.237 . . . . 43.58 108.283 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . 0.45 HD12 HG22 ' H' ' 229' ' ' THR . 16.1 mt -103.8 15.07 29.6 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 122.121 2.237 . . . . 20.61 108.196 -179.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -59.23 -34.4 72.15 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 119.555 3.169 . . . . 37.39 119.555 -177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . 1.24 ' HD2' ' N ' ' H' ' 236' ' ' LYS . 0.0 OUTLIER -74.38 -27.53 60.69 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 119.843 -1.786 . . . . 47.27 112.936 -178.966 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 57.4 t90 -68.31 -39.39 82.05 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 103.809 -2.663 . . . . 27.15 103.809 177.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.496 HD11 HD11 ' H' ' 103' ' ' ILE . 55.6 mt -58.22 -57.22 11.66 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 O-C-N 119.296 -2.127 . . . . 28.54 111.135 179.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.567 ' HG3' ' O ' ' H' ' 496' ' ' HOH . 2.1 mt-30 -51.57 -51.97 51.07 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 125.545 2.593 . . . . 50.0 110.268 -177.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' H' ' 236' ' ' LYS . 5.3 tttm -46.25 -56.33 5.92 Favored 'General case' 0 C--O 1.257 1.453 0 CA-C-N 109.958 -3.292 . . . . 50.0 111.675 179.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . 0.276 1.5 m -66.14 -36.87 78.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.745 0 C-N-CA 117.391 -1.724 . . . . 35.81 111.673 -174.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 33.0 mt -64.7 -45.5 95.08 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 CA-C-N 113.902 -1.499 . . . . 40.82 111.058 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -72.61 -21.13 61.16 Favored 'General case' 0 C--O 1.252 1.195 0 N-CA-C 114.206 1.187 . . . . 50.0 114.206 -177.061 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.006 0 CA-C-O 124.42 2.057 . . . . 50.0 112.233 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 t70 . . . . . 0 N--CA 1.482 1.156 0 CA-C-O 122.785 1.279 . . . . 50.0 107.889 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -72.05 132.13 43.83 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.013 -2.358 . . . . 45.72 108.052 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -75.84 155.02 35.74 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 103.76 -2.681 . . . . 48.29 103.76 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' I' ' 58' ' ' GLU . 0.8 OUTLIER -62.04 139.14 58.45 Favored 'General case' 0 C--N 1.301 -1.542 0 C-N-CA 129.471 3.108 . . . . 50.0 110.159 -179.834 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 28.5 pt -111.39 152.99 44.28 Favored Pre-proline 0 C--O 1.25 1.102 0 CA-C-N 114.717 -1.129 . . . . 48.16 109.152 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.515 ' HB2' ' CD ' ' I' ' 62' ' ' GLU . 5.0 Cg_exo -54.42 137.83 72.75 Favored 'Trans proline' 0 C--O 1.241 0.635 0 O-C-N 125.08 2.095 . . . . 49.8 110.693 179.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLY . . . . . 0.413 ' C ' ' N ' ' I' ' 63' ' ' TYR . . . -64.88 -28.15 73.07 Favored Glycine 0 C--O 1.252 1.264 0 N-CA-C 110.554 -1.019 . . . . 49.82 110.554 179.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLU . . . . . 0.515 ' CD ' ' HB2' ' I' ' 60' ' ' PRO . 16.8 pm0 -58.1 -23.89 56.58 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 116.245 -2.182 . . . . 50.0 106.426 -178.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' TYR . . . . . 0.443 ' CD2' ' HG2' ' I' ' 60' ' ' PRO 0.456 12.9 m-85 -80.67 -16.56 53.67 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 112.891 -1.959 . . . . 49.46 111.415 -172.114 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 64' ' ' LEU . . . . . 0.612 HD23 ' HD3' ' H' ' 36' ' ' LYS . 4.3 mt . . . . . 0 N--CA 1.479 1.021 1 CA-C-O 135.558 7.361 . . . . 50.0 108.619 174.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 404' ' ' HOH . . . . . 0.568 ' O ' ' O ' ' H' ' 77' A ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 422' ' ' HOH . . . . . 0.597 ' O ' ' CD ' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 429' ' ' HOH . . . . . 0.418 ' O ' HG13 ' H' ' 213' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 466' ' ' HOH . . . . . 0.408 ' O ' ' NE ' ' H' ' 126' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 469' ' ' HOH . . . . . 0.76 ' O ' ' NH2' ' H' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 476' ' ' HOH . . . . . 0.971 ' O ' ' HD2' ' H' ' 50' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 486' ' ' HOH . . . . . 0.455 ' O ' ' NH2' ' H' ' 35' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 496' ' ' HOH . . . . . 0.567 ' O ' ' HG3' ' H' ' 239' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 500' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 509' ' ' HOH . . . . . 0.401 ' O ' ' N ' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 513' ' ' HOH . . . . . 0.696 ' O ' ' HE2' ' H' ' 36' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 514' ' ' HOH . . . . . 1.187 ' O ' ' HG3' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 519' ' ' HOH . . . . . 0.713 ' O ' ' HB2' ' H' ' 146' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . 0.73 ' O ' ' HE2' ' H' ' 60' F LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 532' ' ' HOH . . . . . 1.062 ' O ' ' HG2' ' H' ' 187' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_