data_3d49_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 3d49 _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' C GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.01 0.434 . . . . 99.24 111.079 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -49.95 -42.45 48.61 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 117.47 -1.252 . . . . 67.42 112.229 -175.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . . . . . . . . . 32.7 t0 -107.1 11.65 29.35 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 128.209 2.604 . . . . 68.83 113.074 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 29.2 p -56.54 150.78 14.71 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 118.477 -1.289 . . . . 19.09 113.662 -179.423 66.186 79.157 98.416 106.719 2.086 104.02 -60.396 -56.824 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.6 7.95 75.29 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 126.604 2.44 . . . . 11.03 114.468 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 61.9 mt -115.21 110.39 19.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 123.796 1.76 . . . . 19.85 108.04 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -83.36 133.16 47.91 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 115.761 -2.066 . . . . 12.34 112.629 -170.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -52.35 -37.91 72.39 Favored 'Trans proline' 0 C--O 1.261 1.669 0 O-C-N 126.718 2.957 . . . . 15.17 112.594 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.24 3.32 54.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 124.024 3.102 . . . . 35.53 110.154 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -135.57 -90.73 0.3 Allowed 'General case' 0 C--N 1.363 1.168 0 CA-C-O 117.251 -1.357 . . . . 16.5 109.867 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -53.15 -37.47 61.88 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.895 1.679 . . . . 14.98 112.662 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -70.33 -20.45 62.99 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 114.239 -2.791 . . . . 60.88 110.641 -173.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -106.96 5.02 27.82 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 127.458 2.974 . . . . 39.08 113.26 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 50.41 40.56 23.22 Favored 'General case' 0 C--O 1.252 1.187 0 CA-C-O 124.341 2.02 . . . . 23.93 115.454 -170.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.76 134.61 50.47 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 114.613 -1.176 . . . . 21.49 108.87 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -98.28 147.94 24.14 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 123.93 1.824 . . . . 49.04 108.971 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -81.49 171.53 14.6 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.355 -1.465 . . . . 15.08 109.755 173.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . . . . . . . . . 67.6 mttt -73.44 -14.91 61.34 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.929 1.455 . . . . 45.12 114.929 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . . . . . . . . . 71.0 p -128.44 4.85 5.67 Favored 'General case' 0 C--O 1.25 1.108 0 O-C-N 117.787 -3.071 . . . . 17.89 112.591 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.3 pt-20 -62.4 -25.18 67.8 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 122.223 2.283 . . . . 17.26 111.083 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . . . . . . . . . 4.0 mmt85 -72.94 -23.18 60.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 113.973 -3.091 . . . . 56.67 111.505 -177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . . . . . . . . . 82.6 tt0 -55.22 -40.28 70.64 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 121.363 1.892 . . . . 25.49 110.917 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . . . . . . . . . 23.7 mt -67.45 -48.81 66.16 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 115.371 -2.532 . . . . 16.96 112.801 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.93 -40.89 73.8 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 123.388 1.566 . . . . 22.8 111.636 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . . . . . . . . . 95.2 mt-10 -66.27 -22.29 66.3 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 111.857 -2.428 . . . . 31.43 112.554 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . . . . . . . . . 52.0 p -82.04 -9.53 59.52 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 125.147 1.529 . . . . 15.12 111.9 177.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . . . . . . . . . 15.7 m-30 -91.92 72.4 5.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 124.411 2.053 . . . . 18.92 108.568 -175.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 111.872 -2.422 . . . . 58.91 110.165 -169.404 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 23.6 mm . . . . . 0 C--O 1.243 0.731 0 CA-C-O 120.487 0.184 . . . . 20.93 110.99 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . . . . . . . . . 20.0 t -100.89 126.46 54.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 124.634 1.174 . . . . 25.64 109.632 -179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 63.53 32.4 14.2 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.608 0.763 . . . . 60.05 112.945 176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.7 -172.48 39.42 Favored Glycine 0 C--O 1.241 0.576 0 O-C-N 125.64 1.837 . . . . 22.05 111.73 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -129.71 168.33 16.68 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 124.41 2.052 . . . . 35.49 111.196 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -64.66 137.52 57.87 Favored 'General case' 0 N--CA 1.444 -0.767 1 O-C-N 116.2 -4.063 . . . . 38.92 110.522 176.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 155.18 39.54 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 117.047 -1.861 . . . . 19.47 109.801 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -71.86 155.54 40.29 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.84 -1.163 . . . . 23.71 112.47 161.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 32.3 mm -62.07 132.83 27.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.709 0 O-C-N 119.92 -1.738 . . . . 21.42 111.868 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.04 12.96 61.15 Favored Glycine 0 N--CA 1.442 -0.909 0 O-C-N 119.622 -1.924 . . . . 16.37 115.626 -176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 4.3 ttt -71.7 -24.38 61.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 120.293 2.047 . . . . 18.69 113.769 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 24.9 t -137.72 66.05 48.05 Favored Pre-proline 0 C--O 1.253 1.267 0 O-C-N 124.855 1.347 . . . . 12.55 107.868 -176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -72.08 -4.72 15.7 Favored 'Trans proline' 0 C--O 1.247 0.966 0 C-N-CA 123.309 2.673 . . . . 13.6 114.805 -171.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 2.8 p90 -93.5 -4.11 51.71 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 119.824 -1.798 . . . . 12.85 110.392 173.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -68.73 135.67 51.64 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 121.146 1.794 . . . . 30.28 111.07 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 79.7 t -124.2 142.16 41.91 Favored 'Isoleucine or valine' 0 C--O 1.248 0.986 0 N-CA-C 106.091 -1.818 . . . . 13.92 106.091 -179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . . . . . . . . . 42.1 ttm -107.69 124.08 49.46 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.477 -1.305 . . . . 19.06 107.477 172.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.01 122.65 31.15 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.413 -1.329 . . . . 35.48 107.413 171.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -122.7 126.63 47.93 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 117.37 -1.3 . . . . 31.58 109.467 -167.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -73.55 128.54 35.77 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 128.274 3.484 . . . . 48.96 107.628 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -72.24 -36.42 69.08 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 124.475 1.109 . . . . 44.93 113.272 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.9 OUTLIER -159.45 108.91 1.5 Allowed Pre-proline 0 N--CA 1.47 0.547 0 N-CA-C 107.5 -1.296 . . . . 57.3 107.5 -173.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -74.4 144.48 81.11 Favored 'Cis proline' 0 C--N 1.327 -0.585 0 O-C-N 123.435 1.229 . . . . 39.77 112.201 -3.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -60.79 124.89 21.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 124.701 2.191 . . . . 55.77 110.621 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -166.14 157.78 13.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 119.602 -1.937 . . . . 51.01 109.968 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . . . . . . . . . 65.1 tp -57.42 133.15 54.93 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 125.151 1.532 . . . . 30.66 109.768 168.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.94 -46.64 4.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 126.198 2.904 . . . . 40.33 108.853 170.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -167.07 171.49 10.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 119.607 -1.933 . . . . 21.0 109.367 -171.433 -90.565 -154.778 -88.103 104.188 2.053 100.374 -84.571 -75.113 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.63 174.72 39.88 Favored Glycine 0 C--O 1.261 1.825 0 O-C-N 126.885 2.616 . . . . 14.89 109.626 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.39 174.38 1.6 Allowed 'General case' 0 C--O 1.246 0.874 0 CA-C-O 116.975 -1.488 . . . . 13.22 108.058 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 82.6 p -142.67 150.12 39.77 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 127.205 2.816 . . . . 13.13 108.145 -176.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 25.3 tp -88.51 121.16 30.59 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 119.945 -1.722 . . . . 14.87 113.353 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 pt -113.86 -4.49 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 117.343 -1.743 . . . . 15.69 113.293 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 23.0 p -167.86 -179.28 4.15 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 126.842 2.589 . . . . 20.24 107.902 173.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -71.71 -6.01 38.05 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 115.621 -2.432 . . . . 39.58 113.315 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.448 ' NH2' ' OE2' ' H' ' 86' ' ' GLU . 3.3 mmm180 -135.69 6.52 3.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 120.999 1.727 . . . . 55.15 112.967 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -123.21 135.35 54.26 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 116.857 -1.544 . . . . 26.61 110.745 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 97.7 t -122.66 133.75 67.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 O-C-N 126.5 2.375 . . . . 16.77 108.446 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 21.2 tp -104.27 132.95 49.97 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 127.124 2.17 . . . . 15.09 108.838 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -148.71 -174.81 4.71 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-O 115.969 -1.967 . . . . 15.12 110.224 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.66 137.25 32.62 Favored 'General case' 0 C--N 1.315 -0.896 1 O-C-N 129.535 4.272 . . . . 14.97 107.961 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.76 -40.69 69.63 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 125.881 1.988 . . . . 15.54 111.388 173.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -66.18 -18.25 65.23 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-N 120.649 1.568 . . . . 21.37 112.215 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -66.33 -24.78 66.58 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.51 0.671 . . . . 19.53 111.336 174.416 -75.113 -84.571 -88.103 100.374 2.053 104.188 -154.778 -90.565 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 28.0 mt -109.02 -39.14 5.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 116.383 -1.77 . . . . 23.27 110.97 -173.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 52.7 tp -132.88 110.28 10.2 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 127.269 2.856 . . . . 22.1 111.575 -174.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . . . . . . . . . 34.2 t80 -150.2 83.51 6.04 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-O 122.851 1.31 . . . . 24.31 107.698 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . . . . . . . . . 84.2 Cg_exo -53.06 -36.47 76.42 Favored 'Trans proline' 0 C--O 1.268 2.011 0 CA-C-O 116.045 -1.731 . . . . 20.7 115.397 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . . . . . . . . . 85.7 Cg_exo -54.85 -28.81 60.11 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 CA-C-N 126.791 3.461 . . . . 26.27 111.852 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . . . . . . . . . 46.2 m0 -106.7 21.53 17.34 Favored 'General case' 0 C--O 1.25 1.08 0 C-N-CA 119.063 -1.055 . . . . 50.91 110.891 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . . 72.6 m-20 52.02 37.69 21.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 120.392 1.451 . . . . 57.26 112.66 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . . . . . . . . . 2.6 ttmm -104.62 128.01 52.53 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 117.44 -1.704 . . . . 57.97 108.744 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.08 87.92 0.58 Allowed 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 129.102 2.961 . . . . 79.35 107.879 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 82.4 m-85 -94.19 147.35 23.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 117.633 -1.627 . . . . 36.1 109.879 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 11.5 t -107.4 168.14 9.44 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 107.528 -1.286 . . . . 58.59 107.528 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -48.37 -45.99 36.37 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 126.056 2.097 . . . . 34.97 113.036 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -75.36 -7.22 53.41 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 118.475 -1.29 . . . . 53.68 112.795 -171.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -75.92 -14.36 60.26 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 118.124 -0.941 . . . . 49.23 112.449 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mt -133.79 159.44 40.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 117.423 2.379 . . . . 36.93 117.423 -163.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 67.6 mt -127.95 151.76 48.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 113.335 -1.757 . . . . 26.46 111.12 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 1.2 t -110.88 136.39 47.08 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 N-CA-C 107.249 -1.389 . . . . 33.43 107.249 170.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -118.43 122.06 41.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.162 -1.421 . . . . 23.2 107.162 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 29.3 mt -120.15 144.74 27.92 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 O-C-N 124.945 1.403 . . . . 23.35 110.567 -168.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.44 6.33 66.27 Favored Glycine 0 N--CA 1.441 -0.986 0 CA-C-O 124.164 1.98 . . . . 18.33 112.48 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -85.48 157.28 20.49 Favored 'General case' 0 N--CA 1.433 -1.305 1 O-C-N 115.873 -4.31 . . . . 19.91 112.929 -169.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -128.48 -62.5 1.03 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 113.02 -1.9 . . . . 20.55 112.143 170.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 14.2 t -64.76 141.73 58.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 119.712 -1.868 . . . . 27.07 109.593 175.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -68.5 -53.28 24.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.135 -0.626 . . . . 36.36 111.645 176.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 31.7 p -94.66 -26.5 16.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.486 -0.886 . . . . 35.56 113.102 -166.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . . . . -77.29 153.0 34.31 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 116.793 -1.963 . . . . 42.81 111.901 -170.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -84.34 112.22 20.12 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.739 -1.578 . . . . 32.16 106.739 170.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -97.0 79.17 2.85 Favored 'General case' 0 N--CA 1.479 1.017 1 CA-C-O 131.301 5.334 . . . . 22.28 110.61 -169.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . . . . . . . . . 24.7 ttp85 -49.24 129.83 18.64 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 109.604 -3.453 . . . . 26.68 113.84 175.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . . . . . . . . . 31.8 m-20 76.09 11.35 2.97 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 126.798 2.561 . . . . 24.92 112.934 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . . . . . . . . . 98.1 mt -136.4 -63.6 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 113.883 -1.508 . . . . 21.46 111.187 -174.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.48 157.74 28.73 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 127.3 2.875 . . . . 23.32 111.522 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -125.67 144.16 50.72 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 107.322 -1.362 . . . . 41.52 107.322 170.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 17.9 mt -116.87 127.73 74.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.778 0 O-C-N 125.113 1.508 . . . . 36.51 109.686 -176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 45.0 m -126.07 141.6 51.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.615 -1.303 . . . . 31.24 110.507 -170.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . . . . . . . . . 4.5 mtm -91.4 151.86 20.65 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 125.651 2.643 . . . . 45.42 110.847 174.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -92.97 138.01 31.86 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 119.069 -2.269 . . . . 28.19 114.425 -178.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . 0.448 ' OE2' ' NH2' ' H' ' 50' ' ' ARG . 33.1 tt0 -87.47 -40.64 14.16 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 123.263 1.506 . . . . 68.3 109.217 173.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -164.07 140.05 6.34 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 117.478 -3.263 . . . . 57.05 111.368 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 41.8 mt -103.6 139.34 24.83 Favored 'Isoleucine or valine' 0 C--O 1.249 1.043 0 CA-C-O 116.778 -1.582 . . . . 28.24 108.173 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -124.43 113.62 18.4 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.771 1.294 . . . . 39.6 108.795 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 70.0 mt -102.77 139.01 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 O-C-N 126.114 2.134 . . . . 35.77 109.033 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -50.26 130.07 24.37 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 119.542 -0.863 . . . . 19.74 112.556 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.89 -23.36 62.15 Favored 'Trans proline' 0 N--CA 1.476 0.472 0 O-C-N 127.187 3.204 . . . . 28.06 114.229 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -109.54 20.01 18.64 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 118.963 -2.335 . . . . 32.38 113.358 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -53.11 120.53 6.03 Favored 'General case' 0 C--O 1.257 1.471 0 CA-C-O 117.057 -1.449 . . . . 19.07 111.543 165.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -100.66 81.24 2.28 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 125.624 1.828 . . . . 25.01 113.515 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -72.43 -19.33 61.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.82 -1.082 . . . . 22.87 112.299 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -73.05 -33.58 65.77 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 116.968 -1.893 . . . . 34.31 110.878 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . . . . . . . . . 18.6 tt0 -117.96 -70.92 0.76 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 115.745 1.758 . . . . 43.49 115.745 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 26.7 p30 -132.32 10.83 4.51 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 118.606 -1.237 . . . . 18.93 112.193 -169.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt 66.31 28.44 9.85 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 123.527 1.632 . . . . 17.2 112.13 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -59.3 138.62 57.56 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 119.15 -2.219 . . . . 20.21 112.327 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 62.63 48.37 4.37 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 124.863 1.265 . . . . 31.85 110.683 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -82.07 81.59 7.96 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 108.263 -1.014 . . . . 13.76 108.263 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 21.3 tt -150.53 144.94 17.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 C-N-CA 118.292 -1.363 . . . . 14.46 109.433 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.18 146.6 28.79 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.149 1.78 . . . . 16.39 108.509 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -109.83 148.39 31.59 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 124.298 0.999 . . . . 20.34 112.61 165.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . . . . . . . . . 57.3 mtm -123.5 129.17 50.83 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 126.335 2.272 . . . . 25.89 107.005 174.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -95.61 124.41 39.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.245 -1.02 . . . . 37.28 108.245 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 18.4 mt -81.1 150.96 28.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 122.41 1.1 . . . . 26.3 111.331 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 6.0 ttmt -62.61 -37.83 87.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 112.601 -2.09 . . . . 64.33 111.512 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 43.4 mttt -140.15 147.11 49.04 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.192 -0.913 . . . . 53.84 110.497 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -60.48 144.68 99.54 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 125.249 2.184 . . . . 41.36 111.109 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -91.58 143.64 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 107.278 -1.378 . . . . 28.01 107.278 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.86 134.27 35.1 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 125.481 1.738 . . . . 28.38 110.276 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -77.54 155.42 31.61 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 125.454 1.721 . . . . 23.7 106.665 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 29.1 p -154.36 -170.66 3.61 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 124.312 1.008 . . . . 16.16 110.288 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -58.72 -24.52 61.66 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 123.455 1.598 . . . . 20.55 111.643 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -111.92 -8.07 14.12 Favored 'General case' 0 C--O 1.245 0.83 0 O-C-N 119.51 -1.994 . . . . 22.15 111.54 -167.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 40.2 mt -131.56 109.5 15.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 C-N-CA 125.985 1.714 . . . . 19.38 110.6 -173.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -158.31 140.31 10.1 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 114.675 -2.583 . . . . 17.37 111.438 -177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -76.58 152.77 33.89 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 124.371 1.721 . . . . 20.34 112.227 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 5.5 p -89.67 158.91 2.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 113.533 -1.667 . . . . 12.59 110.119 171.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.43 151.54 22.5 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.223 -0.923 . . . . 13.89 110.448 176.815 -56.824 -60.396 98.416 104.02 2.086 106.719 79.157 66.186 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -100.87 144.2 28.06 Favored Pre-proline 0 N--CA 1.465 0.289 0 O-C-N 125.742 1.901 . . . . 25.26 108.409 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -69.36 145.26 58.89 Favored 'Trans proline' 0 C--O 1.217 -0.558 0 N-CA-C 115.488 1.303 . . . . 19.36 115.488 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -85.61 162.98 18.6 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 127.081 2.738 . . . . 37.71 107.316 163.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -54.06 -39.01 65.87 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.045 -2.285 . . . . 52.01 113.098 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.25 -41.77 63.31 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 118.957 -1.097 . . . . 33.67 110.789 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -62.34 -40.44 96.37 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 118.445 -1.302 . . . . 21.52 111.711 174.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.01 99.14 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 117.625 -3.172 . . . . 19.78 111.366 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -62.8 -38.92 92.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 124.37 2.033 . . . . 20.47 111.584 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 56.9 p -75.06 -38.06 61.47 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 123.781 1.753 . . . . 42.84 113.555 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 21.8 mt -95.06 -23.64 17.25 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.429 2.011 . . . . 27.3 116.429 -172.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.11 75.63 8.64 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 117.334 -1.746 . . . . 36.28 111.926 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -129.71 141.32 50.91 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.773 1.296 . . . . 33.64 110.784 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.97 134.19 26.24 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 115.991 -1.957 . . . . 21.85 112.426 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.3 -24.51 22.07 Favored Glycine 0 N--CA 1.445 -0.742 0 O-C-N 125.352 1.657 . . . . 17.81 112.404 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.59 137.07 47.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.352 -1.339 . . . . 31.87 109.01 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -97.54 143.79 27.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.566 -0.454 . . . . 17.67 111.767 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -119.88 -177.59 16.2 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.495 -1.442 . . . . 12.58 109.495 166.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -129.91 132.38 46.35 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 126.541 1.965 . . . . 12.96 108.37 -173.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 16.1 m -117.07 141.31 36.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 C-N-CA 118.134 -1.427 . . . . 12.07 108.975 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 6.6 p -135.32 149.09 49.67 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 124.958 1.411 . . . . 15.1 109.22 -171.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 176.34 168.93 37.17 Favored Glycine 0 N--CA 1.48 1.587 0 C-N-CA 115.351 -3.309 . . . . 14.65 110.498 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 24.6 m-90 -104.83 23.84 12.83 Favored 'General case' 0 C--O 1.242 0.706 0 O-C-N 126.491 1.936 . . . . 21.29 112.591 175.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -80.6 -179.02 52.59 Favored Glycine 0 CA--C 1.509 -0.329 0 C-N-CA 118.535 -1.793 . . . . 21.83 114.182 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -46.51 139.8 4.77 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 116.871 2.174 . . . . 53.6 116.871 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.74 -10.91 59.93 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 123.321 1.534 . . . . 31.46 112.385 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . . . -162.68 160.37 25.53 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 117.8 -1.56 . . . . 49.94 108.713 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--N 1.323 -0.566 0 O-C-N 124.843 1.34 . . . . 50.49 111.149 178.907 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 CA-C-O 119.307 -0.718 . . . . 52.95 111.767 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.71 141.85 24.93 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.444 -0.947 . . . . 57.48 108.444 178.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.71 154.75 39.46 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.202 1.934 . . . . 30.75 113.677 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 5.9 t -74.85 -31.9 61.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 114.829 -1.078 . . . . 33.67 110.64 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 12.6 m -138.39 164.96 25.97 Favored 'Isoleucine or valine' 0 C--N 1.349 0.568 0 CA-C-O 118.535 -0.745 . . . . 21.38 112.132 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 24.2 tp -50.68 136.4 21.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 125.955 2.788 . . . . 18.1 111.482 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 -107.97 150.24 27.36 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 120.17 -1.581 . . . . 19.08 111.0 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 5.9 p -133.13 144.34 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 O-C-N 126.413 2.32 . . . . 26.96 108.508 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.86 142.76 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 121.303 1.865 . . . . 18.78 107.667 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -105.15 132.22 51.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.663 -1.236 . . . . 21.7 107.663 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 95.7 mt -139.44 137.17 18.52 Favored Pre-proline 0 C--O 1.246 0.913 0 O-C-N 124.293 0.996 . . . . 16.56 109.579 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -80.58 139.51 12.73 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 121.548 1.499 . . . . 14.28 114.469 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 75.6 mt -62.22 142.31 16.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.617 -1.253 . . . . 13.86 107.617 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 79.1 t -107.57 148.43 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 125.284 1.615 . . . . 15.79 112.361 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 136.89 58.1 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.231 -1.349 . . . . 64.04 112.949 178.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.442 ' NH2' ' O ' ' H' 2105 ' ' HOH . 13.1 ttt85 -52.24 -39.8 68.17 Favored Pre-proline 0 C--O 1.252 1.216 0 CA-C-O 112.745 -3.502 . . . . 60.75 112.684 -175.837 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -69.69 -31.61 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 CA-C-N 125.044 2.837 . . . . 24.8 111.385 -178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 96.6 t -68.24 -44.3 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 O-C-N 118.763 -2.461 . . . . 21.76 108.025 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 99.0 m -55.88 -52.92 62.4 Favored 'General case' 0 C--N 1.343 0.295 0 O-C-N 124.424 1.077 . . . . 16.92 110.907 174.948 -65.431 -62.946 -93.053 105.142 2.018 103.285 -79.426 92.719 1 1 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . 0.406 ' NZ ' ' NH1' ' H' ' 165' ' ' ARG . 77.2 mttt -61.22 -42.24 98.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 119.948 -0.701 . . . . 39.16 112.137 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -74.24 -4.6 36.99 Favored 'General case' 0 C--O 1.247 0.959 0 N-CA-C 114.919 1.452 . . . . 20.02 114.919 -175.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 26.7 p -90.25 -5.81 55.92 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.965 0.906 . . . . 18.22 111.612 -177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 6.0 t -148.12 157.89 43.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 125.753 1.908 . . . . 15.39 110.556 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -88.08 -11.23 47.7 Favored 'General case' 0 N--CA 1.444 -0.774 0 O-C-N 124.564 1.165 . . . . 26.39 112.856 169.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 21.2 mm -71.42 142.36 15.57 Favored 'Isoleucine or valine' 0 C--O 1.256 1.413 0 N-CA-C 112.944 0.72 . . . . 26.76 112.944 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -70.97 119.34 14.95 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.511 -1.368 . . . . 35.4 110.401 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 9.7 mm -92.16 143.81 10.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 N-CA-C 107.747 -1.205 . . . . 26.67 107.747 -178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 27.5 p -117.1 174.75 5.94 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 120.221 -1.549 . . . . 16.92 112.533 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -68.59 -16.06 63.73 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 127.272 2.858 . . . . 32.79 108.704 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -89.97 11.32 20.87 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 125.923 2.015 . . . . 19.17 110.771 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 28.3 mtt -130.8 154.72 47.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.18 1.792 . . . . 18.9 108.818 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -139.95 164.06 31.0 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 126.033 2.083 . . . . 13.25 108.637 164.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.39 158.44 34.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 116.765 -1.974 . . . . 15.62 109.571 179.586 92.719 -79.426 -93.053 103.285 2.018 105.142 -62.946 -65.431 2 2 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.76 153.06 38.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.286 -1.324 . . . . 15.08 112.63 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 138.5 168.27 11.23 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 126.68 2.488 . . . . 15.77 110.728 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . . . . . . . . . 64.5 m-85 -85.7 148.87 25.67 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 125.75 1.5 . . . . 23.63 109.941 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -83.7 156.37 64.87 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 116.316 -1.802 . . . . 47.3 107.35 175.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_exo -44.95 -39.81 14.59 Favored 'Trans proline' 0 C--N 1.326 -0.612 0 O-C-N 126.631 2.911 . . . . 39.15 113.29 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . . . . . . . . . 3.9 m-20 -98.14 15.74 23.38 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 117.768 -3.082 . . . . 73.67 113.18 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . . . . . . . . . 53.4 mt-10 -83.6 -8.53 59.29 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 124.574 2.13 . . . . 44.85 110.362 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 97.57 -77.81 0.64 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 117.122 -2.466 . . . . 44.57 109.306 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . . . -59.51 158.17 10.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 124.652 2.168 . . . . 47.56 113.867 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 21.5 mtp85 -126.22 179.07 5.43 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 127.022 2.129 . . . . 39.58 112.871 -174.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . . . . . . . . . . . 137.15 146.27 5.1 Favored Glycine 0 C--O 1.229 -0.195 0 C-N-CA 119.846 -1.168 . . . . 19.71 112.793 171.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -169.05 161.89 10.7 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 119.337 -0.945 . . . . 19.36 109.454 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.39 158.37 35.15 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 123.365 0.666 . . . . 17.78 111.734 162.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 8.4 t -144.84 -171.94 3.73 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.449 -1.3 . . . . 28.72 110.258 175.836 -162.365 54.108 76.633 103.294 2.027 104.507 -178.961 -48.832 1 1 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -60.25 133.82 56.46 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 118.819 -2.426 . . . . 38.2 112.764 -176.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 106.0 -26.38 20.91 Favored Glycine 0 CA--C 1.542 1.74 0 CA-C-O 116.482 -2.288 . . . . 18.07 109.276 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -86.04 -21.1 27.92 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 128.799 3.294 . . . . 18.99 113.952 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 4.8 m -33.63 132.26 0.22 Allowed 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 115.106 1.521 . . . . 30.24 115.106 171.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.71 -10.62 73.02 Favored Glycine 0 CA--C 1.545 1.962 0 CA-C-O 115.901 -2.611 . . . . 12.48 111.596 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -80.26 171.81 54.39 Favored Glycine 0 C--O 1.238 0.37 0 O-C-N 127.622 2.601 . . . . 13.02 109.673 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -88.82 145.42 5.52 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 N-CA-C 116.355 1.636 . . . . 15.01 116.355 -173.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -105.23 115.56 30.48 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 104.68 -2.341 . . . . 13.74 104.68 163.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 31.3 m -119.94 156.25 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 123.523 1.63 . . . . 12.05 110.158 -172.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 82.7 mtp -136.18 146.33 46.74 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 112.769 -2.014 . . . . 12.73 108.24 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -99.36 112.88 24.98 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.44 -0.578 . . . . 13.36 109.44 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 27.0 t -65.09 129.57 94.52 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 116.937 -1.905 . . . . 14.23 110.192 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.23 -6.77 15.87 Favored 'Trans proline' 0 N--CA 1.485 1.008 0 O-C-N 126.59 2.889 . . . . 14.7 113.758 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 74.9 m-85 -86.41 -37.64 18.17 Favored 'General case' 0 C--O 1.246 0.898 0 O-C-N 127.508 3.005 . . . . 22.51 112.253 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.1 5.7 4.93 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 118.721 -1.191 . . . . 17.57 113.827 -178.483 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . 0.443 ' ND2' ' O ' ' H' 2066 ' ' HOH . 30.6 m120 57.94 31.74 21.01 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.822 1.249 . . . . 61.94 114.026 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -109.84 148.22 31.91 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.023 0.529 . . . . 26.55 111.008 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -85.31 133.96 34.13 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.663 1.852 . . . . 12.28 111.003 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.82 137.3 54.07 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.312 -2.222 . . . . 14.44 111.234 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -89.42 108.29 19.56 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 117.549 -1.661 . . . . 12.49 110.681 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 66.2 mmm -92.61 -23.53 18.99 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.277 0.473 . . . . 15.27 112.277 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -141.98 160.82 27.16 Favored Glycine 0 C--O 1.244 0.734 0 N-CA-C 110.172 -1.171 . . . . 8.98 110.172 -173.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 66.4 mt -119.4 130.64 73.73 Favored 'Isoleucine or valine' 0 C--O 1.261 1.66 0 CA-C-N 112.978 -1.611 . . . . 12.14 110.139 168.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.77 119.79 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 118.175 -1.41 . . . . 11.58 109.705 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 48.1 t -118.05 -60.79 1.76 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 117.711 -1.595 . . . . 15.67 113.269 -173.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.6 p-90 -157.95 161.39 38.18 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 125.365 2.507 . . . . 18.28 111.843 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -165.54 152.96 22.69 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 104.37 -3.492 . . . . 27.64 104.37 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -95.03 99.46 11.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.995 1.379 . . . . 30.09 107.326 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.41 -172.15 55.0 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 114.369 -3.777 . . . . 25.99 107.079 -173.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 24.4 m -134.8 127.62 31.2 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.849 -1.167 . . . . 26.73 107.849 179.659 -48.832 -178.961 76.633 104.507 2.027 103.294 54.108 -162.365 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 17.4 t0 56.81 36.93 28.41 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 117.284 -1.341 . . . . 27.97 112.534 175.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . . . . . . . . . 66.8 mtt180 -83.43 142.79 30.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 116.522 -2.071 . . . . 48.68 109.996 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.43 135.73 57.83 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 125.666 2.651 . . . . 57.32 110.026 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 84.73 -3.61 86.49 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 111.832 -2.44 . . . . 23.25 112.84 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . 0.522 ' NZ ' ' N1 ' ' H' 1900 ' ' BEN . 0.0 OUTLIER -110.14 158.51 18.25 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.882 2.073 . . . . 21.88 109.072 176.47 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -138.39 154.38 48.92 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 123.284 1.516 . . . . 27.24 110.706 -176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -86.32 146.99 21.27 Favored Glycine 0 C--N 1.351 1.397 0 C-N-CA 115.789 -3.1 . . . . 12.66 109.345 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -108.75 141.67 40.41 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.094 -0.706 . . . . 16.75 109.094 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -129.79 138.97 51.33 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 112.395 -2.184 . . . . 14.37 110.21 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 34.3 m -65.37 132.42 48.96 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 121.021 -1.05 . . . . 11.52 109.996 172.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -84.75 99.78 11.08 Favored 'General case' 0 CA--C 1.5 -0.973 0 N-CA-C 108.513 -0.921 . . . . 13.78 108.513 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.69 -42.53 94.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 CA-C-N 119.128 0.876 . . . . 13.37 111.393 -170.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.64 -40.68 88.47 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 119.03 -2.294 . . . . 21.19 111.773 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -62.4 -22.73 66.38 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 118.676 -1.21 . . . . 49.21 113.102 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 67.8 mt -107.99 13.04 26.47 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-O 123.98 1.848 . . . . 26.31 112.328 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -66.15 -32.57 74.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 118.693 -2.504 . . . . 43.34 112.914 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . . . -58.1 -44.57 87.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 116.719 -1.993 . . . . 44.32 109.095 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -63.74 -43.54 96.2 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 124.974 2.321 . . . . 22.65 111.593 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 97.7 mt -57.82 -45.23 87.29 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 O-C-N 118.042 -2.911 . . . . 21.51 112.397 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . 0.417 ' NE2' ' OD1' ' H' ' 243' ' ' ASP . 47.4 tp60 -63.24 -44.46 95.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.789 0.804 . . . . 53.83 111.354 -178.014 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -45.77 85.79 Favored 'General case' 0 C--O 1.245 0.839 0 CA-C-N 114.723 -1.126 . . . . 72.05 110.215 -179.527 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.34 -47.9 90.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 122.192 0.996 . . . . 25.07 111.476 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 25.9 mt -67.17 -36.41 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 117.557 -1.657 . . . . 39.11 108.099 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . 0.417 ' OD1' ' NE2' ' H' ' 239' ' ' GLN . 80.4 m-20 -67.73 -40.24 84.23 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.224 -0.991 . . . . 49.99 112.491 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -86.35 -21.22 27.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 123.936 1.827 . . . . 85.3 110.166 -173.829 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 . . . . . 0 N--CA 1.465 0.308 0 O-C-N 120.63 -1.294 . . . . 58.99 109.243 174.513 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t0 . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 122.531 1.158 . . . . 79.38 110.499 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -79.96 132.64 36.08 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 119.242 -0.983 . . . . 46.33 112.357 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -65.52 153.29 41.87 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 106.123 -1.806 . . . . 43.75 106.123 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.96 127.68 24.62 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 130.603 3.561 . . . . 52.55 112.288 175.429 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 59' ' ' ILE . . . . . . . . . . . . . 15.9 pt -104.11 143.98 27.76 Favored Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 117.889 -1.524 . . . . 51.75 108.201 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 60' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -48.31 127.55 15.73 Favored 'Trans proline' 0 C--N 1.326 -0.656 0 O-C-N 125.634 2.386 . . . . 52.49 111.594 -177.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . . . -45.5 -33.41 2.69 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.728 -1.124 . . . . 50.02 113.086 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -18.39 58.8 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 117.378 -1.729 . . . . 60.72 111.0 -177.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 63' ' ' TYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 1800 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 1801 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 1900 ' ' BEN . . . . . 0.522 ' N1 ' ' NZ ' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2139 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2146 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2149 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2164 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2166 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2169 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2173 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2174 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2181 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2184 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2186 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2187 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2188 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L 2189 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2066 ' ' HOH . . . . . 0.443 ' O ' ' ND2' ' H' ' 205' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2100 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2105 ' ' HOH . . . . . 0.442 ' O ' ' NH2' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2123 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2124 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2125 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2126 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2130 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2132 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2133 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2134 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2135 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2136 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2137 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2138 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2140 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2141 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2142 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2143 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2144 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2145 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2147 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2148 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2150 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2151 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2152 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2153 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2154 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2155 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2156 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2157 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2158 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2159 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2160 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2161 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2162 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2163 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2165 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2167 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2168 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2170 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2171 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2172 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2175 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2176 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2177 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2178 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2182 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2183 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H 2185 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 2179 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I 2180 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' C GLU . . . . . 0.73 ' HB2' ' HB3' ' L' ' 1' ' ' CYS . 28.1 mm-40 . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.01 0.434 . . . . 99.24 111.079 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -49.95 -42.45 48.61 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 117.47 -1.252 . . . . 67.42 112.229 -175.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . . . . . . . . . 32.7 t0 -107.1 11.65 29.35 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 128.209 2.604 . . . . 68.83 113.074 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . 0.73 ' HB3' ' HB2' ' L' ' 1' C GLU . 29.2 p -56.54 150.78 14.71 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 118.477 -1.289 . . . . 19.09 113.662 -179.423 66.186 79.157 98.416 106.719 2.086 104.02 -60.396 -56.824 2 2 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.6 7.95 75.29 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 126.604 2.44 . . . . 11.03 114.468 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 61.9 mt -115.21 110.39 19.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 123.796 1.76 . . . . 19.85 108.04 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -83.36 133.16 47.91 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 115.761 -2.066 . . . . 12.34 112.629 -170.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -52.35 -37.91 72.39 Favored 'Trans proline' 0 C--O 1.261 1.669 0 O-C-N 126.718 2.957 . . . . 15.17 112.594 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.24 3.32 54.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 124.024 3.102 . . . . 35.53 110.154 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -135.57 -90.73 0.3 Allowed 'General case' 0 C--N 1.363 1.168 0 CA-C-O 117.251 -1.357 . . . . 16.5 109.867 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -53.15 -37.47 61.88 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.895 1.679 . . . . 14.98 112.662 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -70.33 -20.45 62.99 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 114.239 -2.791 . . . . 60.88 110.641 -173.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -106.96 5.02 27.82 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 127.458 2.974 . . . . 39.08 113.26 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 50.41 40.56 23.22 Favored 'General case' 0 C--O 1.252 1.187 0 CA-C-O 124.341 2.02 . . . . 23.93 115.454 -170.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.76 134.61 50.47 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 114.613 -1.176 . . . . 21.49 108.87 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -98.28 147.94 24.14 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 123.93 1.824 . . . . 49.04 108.971 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -81.49 171.53 14.6 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.355 -1.465 . . . . 15.08 109.755 173.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . . . . . . . . . 67.6 mttt -73.44 -14.91 61.34 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.929 1.455 . . . . 45.12 114.929 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . . . . . . . . . 71.0 p -128.44 4.85 5.67 Favored 'General case' 0 C--O 1.25 1.108 0 O-C-N 117.787 -3.071 . . . . 17.89 112.591 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.3 pt-20 -62.4 -25.18 67.8 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 122.223 2.283 . . . . 17.26 111.083 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 0.562 ' HG2' ' O ' ' L' 2173 ' ' HOH . 4.0 mmt85 -72.94 -23.18 60.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 113.973 -3.091 . . . . 56.67 111.505 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . . . . . . . . . 82.6 tt0 -55.22 -40.28 70.64 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 121.363 1.892 . . . . 25.49 110.917 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . . . . . . . . . 23.7 mt -67.45 -48.81 66.16 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 115.371 -2.532 . . . . 16.96 112.801 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.93 -40.89 73.8 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 123.388 1.566 . . . . 22.8 111.636 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . . . . . . . . . 95.2 mt-10 -66.27 -22.29 66.3 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 111.857 -2.428 . . . . 31.43 112.554 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . . . . . . . . . 52.0 p -82.04 -9.53 59.52 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 125.147 1.529 . . . . 15.12 111.9 177.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . . . . . . . . . 15.7 m-30 -91.92 72.4 5.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 124.411 2.053 . . . . 18.92 108.568 -175.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 111.872 -2.422 . . . . 58.91 110.165 -169.404 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 23.6 mm . . . . . 0 C--O 1.243 0.731 0 CA-C-O 120.487 0.184 . . . . 20.93 110.99 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 20.0 t -100.89 126.46 54.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 124.634 1.174 . . . . 25.64 109.632 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.686 ' OE1' ' HD3' ' H' ' 187' ' ' ARG . 3.3 mm-40 63.53 32.4 14.2 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.608 0.763 . . . . 60.05 112.945 176.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.7 -172.48 39.42 Favored Glycine 0 C--O 1.241 0.576 0 O-C-N 125.64 1.837 . . . . 22.05 111.73 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -129.71 168.33 16.68 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 124.41 2.052 . . . . 35.49 111.196 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -64.66 137.52 57.87 Favored 'General case' 0 N--CA 1.444 -0.767 1 O-C-N 116.2 -4.063 . . . . 38.92 110.522 176.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 155.18 39.54 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 117.047 -1.861 . . . . 19.47 109.801 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -71.86 155.54 40.29 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.84 -1.163 . . . . 23.71 112.47 161.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 32.3 mm -62.07 132.83 27.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.709 0 O-C-N 119.92 -1.738 . . . . 21.42 111.868 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.04 12.96 61.15 Favored Glycine 0 N--CA 1.442 -0.909 0 O-C-N 119.622 -1.924 . . . . 16.37 115.626 -176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 4.3 ttt -71.7 -24.38 61.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 120.293 2.047 . . . . 18.69 113.769 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 24.9 t -137.72 66.05 48.05 Favored Pre-proline 0 C--O 1.253 1.267 0 O-C-N 124.855 1.347 . . . . 12.55 107.868 -176.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -72.08 -4.72 15.7 Favored 'Trans proline' 0 C--O 1.247 0.966 0 C-N-CA 123.309 2.673 . . . . 13.6 114.805 -171.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . 0.442 ' CG ' ' HB ' ' H' ' 121' ' ' VAL . 2.8 p90 -93.5 -4.11 51.71 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 119.824 -1.798 . . . . 12.85 110.392 173.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -68.73 135.67 51.64 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 121.146 1.794 . . . . 30.28 111.07 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . 0.453 ' CG1' HG22 ' H' ' 66' ' ' VAL . 79.7 t -124.2 142.16 41.91 Favored 'Isoleucine or valine' 0 C--O 1.248 0.986 0 N-CA-C 106.091 -1.818 . . . . 13.92 106.091 -179.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . 0.479 ' HB2' ' CZ3' ' H' ' 141' ' ' TRP . 42.1 ttm -107.69 124.08 49.46 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.477 -1.305 . . . . 19.06 107.477 172.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.01 122.65 31.15 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.413 -1.329 . . . . 35.48 107.413 171.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . 0.537 ' CZ ' ' HB3' ' H' ' 38' ' ' GLN . 41.8 t80 -122.7 126.63 47.93 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 117.37 -1.3 . . . . 31.58 109.467 -167.465 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.631 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 11.2 ttt180 -73.55 128.54 35.77 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 128.274 3.484 . . . . 48.96 107.628 176.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -72.24 -36.42 69.08 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 124.475 1.109 . . . . 44.93 113.272 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.9 OUTLIER -159.45 108.91 1.5 Allowed Pre-proline 0 N--CA 1.47 0.547 0 N-CA-C 107.5 -1.296 . . . . 57.3 107.5 -173.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -74.4 144.48 81.11 Favored 'Cis proline' 0 C--N 1.327 -0.585 0 O-C-N 123.435 1.229 . . . . 39.77 112.201 -3.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.631 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 84.4 mt-30 -60.79 124.89 21.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 124.701 2.191 . . . . 55.77 110.621 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.583 ' HG2' ' HB3' ' H' ' 35' ' ' ARG . 17.8 pt-20 -166.14 157.78 13.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 119.602 -1.937 . . . . 51.01 109.968 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . 0.443 ' CD1' ' HG3' ' H' ' 32' ' ' MET . 65.1 tp -57.42 133.15 54.93 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 125.151 1.532 . . . . 30.66 109.768 168.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.94 -46.64 4.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 126.198 2.904 . . . . 40.33 108.853 170.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -167.07 171.49 10.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 119.607 -1.933 . . . . 21.0 109.367 -171.433 -90.565 -154.778 -88.103 104.188 2.053 100.374 -84.571 -75.113 1 1 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.63 174.72 39.88 Favored Glycine 0 C--O 1.261 1.825 0 O-C-N 126.885 2.616 . . . . 14.89 109.626 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.39 174.38 1.6 Allowed 'General case' 0 C--O 1.246 0.874 0 CA-C-O 116.975 -1.488 . . . . 13.22 108.058 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 82.6 p -142.67 150.12 39.77 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 127.205 2.816 . . . . 13.13 108.145 -176.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 25.3 tp -88.51 121.16 30.59 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 119.945 -1.722 . . . . 14.87 113.353 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 pt -113.86 -4.49 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 117.343 -1.743 . . . . 15.69 113.293 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 23.0 p -167.86 -179.28 4.15 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 126.842 2.589 . . . . 20.24 107.902 173.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -71.71 -6.01 38.05 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 115.621 -2.432 . . . . 39.58 113.315 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 0.649 ' HD3' ' HD3' ' H' ' 111' ' ' PRO . 3.3 mmm180 -135.69 6.52 3.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 120.999 1.727 . . . . 55.15 112.967 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -123.21 135.35 54.26 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 116.857 -1.544 . . . . 26.61 110.745 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 97.7 t -122.66 133.75 67.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 O-C-N 126.5 2.375 . . . . 16.77 108.446 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 21.2 tp -104.27 132.95 49.97 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 127.124 2.17 . . . . 15.09 108.838 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -148.71 -174.81 4.71 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-O 115.969 -1.967 . . . . 15.12 110.224 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.66 137.25 32.62 Favored 'General case' 0 C--N 1.315 -0.896 1 O-C-N 129.535 4.272 . . . . 14.97 107.961 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.76 -40.69 69.63 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 125.881 1.988 . . . . 15.54 111.388 173.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -66.18 -18.25 65.23 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-N 120.649 1.568 . . . . 21.37 112.215 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -66.33 -24.78 66.58 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.51 0.671 . . . . 19.53 111.336 174.416 -75.113 -84.571 -88.103 100.374 2.053 104.188 -154.778 -90.565 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 28.0 mt -109.02 -39.14 5.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 116.383 -1.77 . . . . 23.27 110.97 -173.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 52.7 tp -132.88 110.28 10.2 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 127.269 2.856 . . . . 22.1 111.575 -174.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . . . . . . . . . 34.2 t80 -150.2 83.51 6.04 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-O 122.851 1.31 . . . . 24.31 107.698 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . . . . . . . . . 84.2 Cg_exo -53.06 -36.47 76.42 Favored 'Trans proline' 0 C--O 1.268 2.011 0 CA-C-O 116.045 -1.731 . . . . 20.7 115.397 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . . . . . . . . . 85.7 Cg_exo -54.85 -28.81 60.11 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 CA-C-N 126.791 3.461 . . . . 26.27 111.852 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . . . . . . . . . 46.2 m0 -106.7 21.53 17.34 Favored 'General case' 0 C--O 1.25 1.08 0 C-N-CA 119.063 -1.055 . . . . 50.91 110.891 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . . 72.6 m-20 52.02 37.69 21.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 120.392 1.451 . . . . 57.26 112.66 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . . . . . . . . . 2.6 ttmm -104.62 128.01 52.53 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 117.44 -1.704 . . . . 57.97 108.744 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . . . . . . . . . 54.3 t-20 -163.08 87.92 0.58 Allowed 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 129.102 2.961 . . . . 79.35 107.879 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . . . . . . . . . 82.4 m-85 -94.19 147.35 23.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 117.633 -1.627 . . . . 36.1 109.879 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . . . . . . . . . 11.5 t -107.4 168.14 9.44 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 107.528 -1.286 . . . . 58.59 107.528 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -48.37 -45.99 36.37 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 126.056 2.097 . . . . 34.97 113.036 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -75.36 -7.22 53.41 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 118.475 -1.29 . . . . 53.68 112.795 -171.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -75.92 -14.36 60.26 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 118.124 -0.941 . . . . 49.23 112.449 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mt -133.79 159.44 40.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 117.423 2.379 . . . . 36.93 117.423 -163.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 67.6 mt -127.95 151.76 48.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 113.335 -1.757 . . . . 26.46 111.12 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . 0.608 HG23 ' HB2' ' H' ' 83' ' ' SER . 1.2 t -110.88 136.39 47.08 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 N-CA-C 107.249 -1.389 . . . . 33.43 107.249 170.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -118.43 122.06 41.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.162 -1.421 . . . . 23.2 107.162 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 29.3 mt -120.15 144.74 27.92 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 O-C-N 124.945 1.403 . . . . 23.35 110.567 -168.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.44 6.33 66.27 Favored Glycine 0 N--CA 1.441 -0.986 0 CA-C-O 124.164 1.98 . . . . 18.33 112.48 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -85.48 157.28 20.49 Favored 'General case' 0 N--CA 1.433 -1.305 1 O-C-N 115.873 -4.31 . . . . 19.91 112.929 -169.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -128.48 -62.5 1.03 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 113.02 -1.9 . . . . 20.55 112.143 170.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 14.2 t -64.76 141.73 58.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 119.712 -1.868 . . . . 27.07 109.593 175.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . 0.526 ' CZ ' ' HB2' ' H' ' 151' ' ' GLN . 63.4 ttp85 -68.5 -53.28 24.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.135 -0.626 . . . . 36.36 111.645 176.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 31.7 p -94.66 -26.5 16.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.486 -0.886 . . . . 35.56 113.102 -166.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . . . . -77.29 153.0 34.31 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 116.793 -1.963 . . . . 42.81 111.901 -170.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -84.34 112.22 20.12 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.739 -1.578 . . . . 32.16 106.739 170.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . 0.552 ' HB3' HG23 ' H' ' 79' ' ' ILE . 50.8 mt-10 -97.0 79.17 2.85 Favored 'General case' 0 N--CA 1.479 1.017 1 CA-C-O 131.301 5.334 . . . . 22.28 110.61 -169.564 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.411 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 24.7 ttp85 -49.24 129.83 18.64 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 109.604 -3.453 . . . . 26.68 113.84 175.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' H' ' 77' A ARG . 31.8 m-20 76.09 11.35 2.97 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 126.798 2.561 . . . . 24.92 112.934 175.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . 0.743 HD11 ' O ' ' H' 2047 ' ' HOH . 98.1 mt -136.4 -63.6 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 113.883 -1.508 . . . . 21.46 111.187 -174.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.48 157.74 28.73 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 127.3 2.875 . . . . 23.32 111.522 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . 0.442 ' HB3' ' HE2' ' H' ' 81' ' ' LYS . 1.8 mmmm -125.67 144.16 50.72 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 107.322 -1.362 . . . . 41.52 107.322 170.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 17.9 mt -116.87 127.73 74.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.778 0 O-C-N 125.113 1.508 . . . . 36.51 109.686 -176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . 0.608 ' HB2' HG23 ' H' ' 66' ' ' VAL . 45.0 m -126.07 141.6 51.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.615 -1.303 . . . . 31.24 110.507 -170.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . 0.498 ' CE ' ' HD2' ' H' ' 109' ' ' LYS . 4.5 mtm -91.4 151.86 20.65 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 125.651 2.643 . . . . 45.42 110.847 174.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.44 HD12 ' HB3' ' H' ' 106' ' ' MET . 2.9 mm? -92.97 138.01 31.86 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 119.069 -2.269 . . . . 28.19 114.425 -178.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . 0.448 ' OE2' ' NH2' ' H' ' 50' ' ' ARG . 33.1 tt0 -87.47 -40.64 14.16 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 123.263 1.506 . . . . 68.3 109.217 173.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -164.07 140.05 6.34 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 117.478 -3.263 . . . . 57.05 111.368 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 41.8 mt -103.6 139.34 24.83 Favored 'Isoleucine or valine' 0 C--O 1.249 1.043 0 CA-C-O 116.778 -1.582 . . . . 28.24 108.173 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -124.43 113.62 18.4 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.771 1.294 . . . . 39.6 108.795 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 70.0 mt -102.77 139.01 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 O-C-N 126.114 2.134 . . . . 35.77 109.033 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -50.26 130.07 24.37 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 119.542 -0.863 . . . . 19.74 112.556 173.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.89 -23.36 62.15 Favored 'Trans proline' 0 N--CA 1.476 0.472 0 O-C-N 127.187 3.204 . . . . 28.06 114.229 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -109.54 20.01 18.64 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 118.963 -2.335 . . . . 32.38 113.358 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -53.11 120.53 6.03 Favored 'General case' 0 C--O 1.257 1.471 0 CA-C-O 117.057 -1.449 . . . . 19.07 111.543 165.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -100.66 81.24 2.28 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 125.624 1.828 . . . . 25.01 113.515 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -72.43 -19.33 61.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.82 -1.082 . . . . 22.87 112.299 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -73.05 -33.58 65.77 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 116.968 -1.893 . . . . 34.31 110.878 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . . . . . . . . . 18.6 tt0 -117.96 -70.92 0.76 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 115.745 1.758 . . . . 43.49 115.745 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 26.7 p30 -132.32 10.83 4.51 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 118.606 -1.237 . . . . 18.93 112.193 -169.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt 66.31 28.44 9.85 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 123.527 1.632 . . . . 19.6 112.13 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -59.3 138.62 57.56 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 119.15 -2.219 . . . . 20.21 112.327 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 62.63 48.37 4.37 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 124.863 1.265 . . . . 31.85 110.683 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -82.07 81.59 7.96 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 108.263 -1.014 . . . . 13.76 108.263 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 21.3 tt -150.53 144.94 17.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 C-N-CA 118.292 -1.363 . . . . 14.46 109.433 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.18 146.6 28.79 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.149 1.78 . . . . 16.39 108.509 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -109.83 148.39 31.59 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 124.298 0.999 . . . . 20.34 112.61 165.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.44 ' HB3' HD12 ' H' ' 85' ' ' LEU . 57.3 mtm -123.5 129.17 50.83 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 126.335 2.272 . . . . 25.89 107.005 174.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -95.61 124.41 39.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.245 -1.02 . . . . 37.28 108.245 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 18.4 mt -81.1 150.96 28.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 122.41 1.1 . . . . 26.3 111.331 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . 0.498 ' HD2' ' CE ' ' H' ' 84' ' ' MET . 6.0 ttmt -62.61 -37.83 87.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 112.601 -2.09 . . . . 64.33 111.512 179.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 43.4 mttt -140.15 147.11 49.04 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.192 -0.913 . . . . 53.84 110.497 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 0.649 ' HD3' ' HD3' ' H' ' 50' ' ' ARG . 31.3 Cg_endo -60.48 144.68 99.54 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 125.249 2.184 . . . . 41.36 111.109 177.255 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -91.58 143.64 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 107.278 -1.378 . . . . 28.01 107.278 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.86 134.27 35.1 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 125.481 1.738 . . . . 28.38 110.276 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -77.54 155.42 31.61 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 125.454 1.721 . . . . 23.7 106.665 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 29.1 p -154.36 -170.66 3.61 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 124.312 1.008 . . . . 16.16 110.288 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -58.72 -24.52 61.66 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 123.455 1.598 . . . . 20.55 111.643 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -111.92 -8.07 14.12 Favored 'General case' 0 C--O 1.245 0.83 0 O-C-N 119.51 -1.994 . . . . 22.15 111.54 -167.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 40.2 mt -131.56 109.5 15.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 C-N-CA 125.985 1.714 . . . . 19.38 110.6 -173.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -158.31 140.31 10.1 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 114.675 -2.583 . . . . 17.37 111.438 -177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -76.58 152.77 33.89 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 124.371 1.721 . . . . 20.34 112.227 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' H' ' 29' ' ' TRP . 5.5 p -89.67 158.91 2.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 113.533 -1.667 . . . . 12.59 110.119 171.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.43 151.54 22.5 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.223 -0.923 . . . . 13.89 110.448 176.815 -56.824 -60.396 98.416 104.02 2.086 106.719 79.157 66.186 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -100.87 144.2 28.06 Favored Pre-proline 0 N--CA 1.465 0.289 0 O-C-N 125.742 1.901 . . . . 25.26 108.409 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -69.36 145.26 58.89 Favored 'Trans proline' 0 C--O 1.217 -0.558 0 N-CA-C 115.488 1.303 . . . . 19.36 115.488 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -85.61 162.98 18.6 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 127.081 2.738 . . . . 37.71 107.316 163.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -54.06 -39.01 65.87 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.045 -2.285 . . . . 52.01 113.098 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.25 -41.77 63.31 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 118.957 -1.097 . . . . 33.67 110.789 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -62.34 -40.44 96.37 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 118.445 -1.302 . . . . 21.52 111.711 174.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.01 99.14 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 117.625 -3.172 . . . . 19.78 111.366 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -62.8 -38.92 92.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 124.37 2.033 . . . . 20.47 111.584 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 56.9 p -75.06 -38.06 61.47 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 123.781 1.753 . . . . 42.84 113.555 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 21.8 mt -95.06 -23.64 17.25 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.429 2.011 . . . . 27.3 116.429 -172.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.11 75.63 8.64 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 117.334 -1.746 . . . . 36.28 111.926 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -129.71 141.32 50.91 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.773 1.296 . . . . 33.64 110.784 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.97 134.19 26.24 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 115.991 -1.957 . . . . 21.85 112.426 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.3 -24.51 22.07 Favored Glycine 0 N--CA 1.445 -0.742 0 O-C-N 125.352 1.657 . . . . 17.81 112.404 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.59 137.07 47.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.352 -1.339 . . . . 31.87 109.01 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -97.54 143.79 27.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.566 -0.454 . . . . 17.67 111.767 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -119.88 -177.59 16.2 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.495 -1.442 . . . . 12.58 109.495 166.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -129.91 132.38 46.35 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 126.541 1.965 . . . . 12.96 108.37 -173.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 16.1 m -117.07 141.31 36.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 C-N-CA 118.134 -1.427 . . . . 12.68 108.975 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 6.6 p -135.32 149.09 49.67 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 124.958 1.411 . . . . 15.1 109.22 -171.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 176.34 168.93 37.17 Favored Glycine 0 N--CA 1.48 1.587 0 C-N-CA 115.351 -3.309 . . . . 14.65 110.498 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' H' ' 32' ' ' MET . 24.6 m-90 -104.83 23.84 12.83 Favored 'General case' 0 C--O 1.242 0.706 0 O-C-N 126.491 1.936 . . . . 21.29 112.591 175.332 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -80.6 -179.02 52.59 Favored Glycine 0 CA--C 1.509 -0.329 0 C-N-CA 118.535 -1.793 . . . . 21.83 114.182 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . 0.727 ' ND2' ' HB3' ' H' ' 192' ' ' GLU . 63.7 m-20 -46.51 139.8 4.77 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 116.871 2.174 . . . . 53.6 116.871 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.74 -10.91 59.93 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 123.321 1.534 . . . . 31.46 112.385 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . . . -162.68 160.37 25.53 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 117.8 -1.56 . . . . 49.94 108.713 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--N 1.323 -0.566 0 O-C-N 124.843 1.34 . . . . 50.49 111.149 178.907 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 CA-C-O 119.307 -0.718 . . . . 52.95 111.767 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 0.526 ' HB2' ' CZ ' ' H' ' 73' ' ' ARG . 0.0 OUTLIER -110.71 141.85 24.93 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.444 -0.947 . . . . 57.48 108.444 178.4 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.71 154.75 39.46 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.202 1.934 . . . . 30.75 113.677 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 5.9 t -74.85 -31.9 61.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 114.829 -1.078 . . . . 33.67 110.64 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 12.6 m -138.39 164.96 25.97 Favored 'Isoleucine or valine' 0 C--N 1.349 0.568 0 CA-C-O 118.535 -0.745 . . . . 21.38 112.132 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 24.2 tp -50.68 136.4 21.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 125.955 2.788 . . . . 18.1 111.482 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 -107.97 150.24 27.36 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 120.17 -1.581 . . . . 19.08 111.0 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 5.9 p -133.13 144.34 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 O-C-N 126.413 2.32 . . . . 26.96 108.508 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.86 142.76 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 121.303 1.865 . . . . 18.78 107.667 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -105.15 132.22 51.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.663 -1.236 . . . . 21.7 107.663 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 95.7 mt -139.44 137.17 18.52 Favored Pre-proline 0 C--O 1.246 0.913 0 O-C-N 124.293 0.996 . . . . 16.56 109.579 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -80.58 139.51 12.73 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 121.548 1.499 . . . . 14.28 114.469 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 75.6 mt -62.22 142.31 16.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.617 -1.253 . . . . 13.86 107.617 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 79.1 t -107.57 148.43 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 125.284 1.615 . . . . 15.79 112.361 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' H' 2042 ' ' HOH . 0.0 OUTLIER -59.21 136.89 58.1 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.231 -1.349 . . . . 64.04 112.949 178.118 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.428 ' NH2' ' O ' ' H' 2105 ' ' HOH . 13.1 ttt85 -52.24 -39.8 68.17 Favored Pre-proline 0 C--O 1.252 1.216 0 CA-C-O 112.745 -3.502 . . . . 60.75 112.684 -175.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' H' ' 164' ' ' GLU . 13.4 Cg_exo -69.69 -31.61 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 CA-C-N 125.044 2.837 . . . . 24.8 111.385 -178.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 96.6 t -68.24 -44.3 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 O-C-N 118.763 -2.461 . . . . 21.76 108.025 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 99.0 m -55.88 -52.92 62.4 Favored 'General case' 0 C--N 1.343 0.295 0 O-C-N 124.424 1.077 . . . . 16.92 110.907 174.948 -65.431 -62.946 -93.053 105.142 2.018 103.285 -79.426 92.719 1 1 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . 0.406 ' NZ ' ' NH1' ' H' ' 165' ' ' ARG . 77.2 mttt -61.22 -42.24 98.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 119.948 -0.701 . . . . 39.16 112.137 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -74.24 -4.6 36.99 Favored 'General case' 0 C--O 1.247 0.959 0 N-CA-C 114.919 1.452 . . . . 20.02 114.919 -175.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . 0.689 ' O ' ' H6 ' ' H' 1900 ' ' BEN . 26.7 p -90.25 -5.81 55.92 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.965 0.906 . . . . 18.22 111.612 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 6.0 t -148.12 157.89 43.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 125.753 1.908 . . . . 15.39 110.556 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -88.08 -11.23 47.7 Favored 'General case' 0 N--CA 1.444 -0.774 0 O-C-N 124.564 1.165 . . . . 26.39 112.856 169.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 21.2 mm -71.42 142.36 15.57 Favored 'Isoleucine or valine' 0 C--O 1.256 1.413 0 N-CA-C 112.944 0.72 . . . . 26.76 112.944 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -70.97 119.34 14.95 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.511 -1.368 . . . . 35.4 110.401 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 9.7 mm -92.16 143.81 10.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 N-CA-C 107.747 -1.205 . . . . 26.67 107.747 -178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 27.5 p -117.1 174.75 5.94 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 120.221 -1.549 . . . . 16.92 112.533 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -68.59 -16.06 63.73 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 127.272 2.858 . . . . 32.79 108.704 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -89.97 11.32 20.87 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 125.923 2.015 . . . . 19.17 110.771 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 28.3 mtt -130.8 154.72 47.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.18 1.792 . . . . 18.9 108.818 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -139.95 164.06 31.0 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 126.033 2.083 . . . . 13.25 108.637 164.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.39 158.44 34.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 116.765 -1.974 . . . . 15.62 109.571 179.586 92.719 -79.426 -93.053 103.285 2.018 105.142 -62.946 -65.431 2 2 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.76 153.06 38.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.286 -1.324 . . . . 15.08 112.63 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 138.5 168.27 11.23 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 126.68 2.488 . . . . 15.77 110.728 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . . . . . . . . . 64.5 m-85 -85.7 148.87 25.67 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 125.75 1.5 . . . . 23.63 109.941 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -83.7 156.37 64.87 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 116.316 -1.802 . . . . 47.3 107.35 175.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_exo -44.95 -39.81 14.59 Favored 'Trans proline' 0 C--N 1.326 -0.612 0 O-C-N 126.631 2.911 . . . . 39.15 113.29 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . . . . . . . . . 3.9 m-20 -98.14 15.74 23.38 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 117.768 -3.082 . . . . 73.67 113.18 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . . . . . . . . . 53.4 mt-10 -83.6 -8.53 59.29 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 124.574 2.13 . . . . 44.85 110.362 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 97.57 -77.81 0.64 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 117.122 -2.466 . . . . 44.57 109.306 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . . . -59.51 158.17 10.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 124.652 2.168 . . . . 47.56 113.867 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.686 ' HD3' ' OE1' ' H' ' 18' ' ' GLU . 21.5 mtp85 -126.22 179.07 5.43 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 127.022 2.129 . . . . 39.58 112.871 -174.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 137.15 146.27 5.1 Favored Glycine 0 C--O 1.229 -0.195 0 C-N-CA 119.846 -1.168 . . . . 19.71 112.793 171.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -169.05 161.89 10.7 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 119.337 -0.945 . . . . 19.36 109.454 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.39 158.37 35.15 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 123.365 0.666 . . . . 17.78 111.734 162.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 8.4 t -144.84 -171.94 3.73 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.449 -1.3 . . . . 28.72 110.258 175.836 -162.365 54.108 76.633 103.294 2.027 104.507 -178.961 -48.832 1 1 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . 0.727 ' HB3' ' ND2' ' H' ' 143' ' ' ASN . 26.8 tt0 -60.25 133.82 56.46 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 118.819 -2.426 . . . . 38.2 112.764 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 106.0 -26.38 20.91 Favored Glycine 0 CA--C 1.542 1.74 0 CA-C-O 116.482 -2.288 . . . . 18.07 109.276 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -86.04 -21.1 27.92 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 128.799 3.294 . . . . 18.99 113.952 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 4.8 m -33.63 132.26 0.22 Allowed 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 115.106 1.521 . . . . 30.24 115.106 171.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.71 -10.62 73.02 Favored Glycine 0 CA--C 1.545 1.962 0 CA-C-O 115.901 -2.611 . . . . 12.48 111.596 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -80.26 171.81 54.39 Favored Glycine 0 C--O 1.238 0.37 0 O-C-N 127.622 2.601 . . . . 13.02 109.673 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -88.82 145.42 5.52 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 N-CA-C 116.355 1.636 . . . . 15.01 116.355 -173.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -105.23 115.56 30.48 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 104.68 -2.341 . . . . 13.74 104.68 163.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 31.3 m -119.94 156.25 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 123.523 1.63 . . . . 12.05 110.158 -172.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 82.7 mtp -136.18 146.33 46.74 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 112.769 -2.014 . . . . 12.73 108.24 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -99.36 112.88 24.98 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.44 -0.578 . . . . 13.36 109.44 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 27.0 t -65.09 129.57 94.52 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 116.937 -1.905 . . . . 14.23 110.192 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.23 -6.77 15.87 Favored 'Trans proline' 0 N--CA 1.485 1.008 0 O-C-N 126.59 2.889 . . . . 14.7 113.758 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 74.9 m-85 -86.41 -37.64 18.17 Favored 'General case' 0 C--O 1.246 0.898 0 O-C-N 127.508 3.005 . . . . 22.51 112.253 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . . . . . . . . . 50.6 p-10 -130.1 5.7 4.93 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 118.721 -1.191 . . . . 17.57 113.827 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 57.94 31.74 21.01 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.822 1.249 . . . . 61.94 114.026 176.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -109.84 148.22 31.91 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.023 0.529 . . . . 26.55 111.008 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -85.31 133.96 34.13 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.663 1.852 . . . . 12.28 111.003 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.82 137.3 54.07 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.312 -2.222 . . . . 14.44 111.234 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -89.42 108.29 19.56 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 117.549 -1.661 . . . . 12.49 110.681 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 66.2 mmm -92.61 -23.53 18.99 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.277 0.473 . . . . 15.27 112.277 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -141.98 160.82 27.16 Favored Glycine 0 C--O 1.244 0.734 0 N-CA-C 110.172 -1.171 . . . . 8.98 110.172 -173.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 66.4 mt -119.4 130.64 73.73 Favored 'Isoleucine or valine' 0 C--O 1.261 1.66 0 CA-C-N 112.978 -1.611 . . . . 12.14 110.139 168.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.77 119.79 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 118.175 -1.41 . . . . 11.58 109.705 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 48.1 t -118.05 -60.79 1.76 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 117.711 -1.595 . . . . 15.67 113.269 -173.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.6 p-90 -157.95 161.39 38.18 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 125.365 2.507 . . . . 18.28 111.843 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -165.54 152.96 22.69 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 104.37 -3.492 . . . . 27.64 104.37 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . 0.787 ' HB2' ' HD2' ' H' ' 224' ' ' LYS . 45.0 mt-10 -95.03 99.46 11.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.995 1.379 . . . . 30.09 107.326 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.41 -172.15 55.0 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 114.369 -3.777 . . . . 25.99 107.079 -173.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 24.4 m -134.8 127.62 31.2 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.849 -1.167 . . . . 26.73 107.849 179.659 -48.832 -178.961 76.633 104.507 2.027 103.294 54.108 -162.365 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 17.4 t0 56.81 36.93 28.41 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 117.284 -1.341 . . . . 27.97 112.534 175.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . 0.697 ' HB2' ' HD2' ' H' ' 224' ' ' LYS . 66.8 mtt180 -83.43 142.79 30.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 116.522 -2.071 . . . . 48.68 109.996 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.43 135.73 57.83 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 125.666 2.651 . . . . 57.32 110.026 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 84.73 -3.61 86.49 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 111.832 -2.44 . . . . 23.25 112.84 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . 0.787 ' HD2' ' HB2' ' H' ' 217' ' ' GLU . 0.0 OUTLIER -110.14 158.51 18.25 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.882 2.073 . . . . 21.88 109.072 176.47 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . 0.471 ' O ' ' HE3' ' H' ' 224' ' ' LYS . 97.4 m-85 -138.39 154.38 48.92 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 123.284 1.516 . . . . 27.24 110.706 -176.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -86.32 146.99 21.27 Favored Glycine 0 C--N 1.351 1.397 0 C-N-CA 115.789 -3.1 . . . . 12.66 109.345 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -108.75 141.67 40.41 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.094 -0.706 . . . . 16.75 109.094 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -129.79 138.97 51.33 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 112.395 -2.184 . . . . 14.37 110.21 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . 0.42 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 34.3 m -65.37 132.42 48.96 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 121.021 -1.05 . . . . 11.52 109.996 172.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -84.75 99.78 11.08 Favored 'General case' 0 CA--C 1.5 -0.973 0 N-CA-C 108.513 -0.921 . . . . 13.78 108.513 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.69 -42.53 94.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 CA-C-N 119.128 0.876 . . . . 13.37 111.393 -170.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.64 -40.68 88.47 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 119.03 -2.294 . . . . 21.19 111.773 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -62.4 -22.73 66.38 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 118.676 -1.21 . . . . 49.21 113.102 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 67.8 mt -107.99 13.04 26.47 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-O 123.98 1.848 . . . . 26.31 112.328 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -66.15 -32.57 74.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 118.693 -2.504 . . . . 43.34 112.914 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . . . -58.1 -44.57 87.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 116.719 -1.993 . . . . 44.32 109.095 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -63.74 -43.54 96.2 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 124.974 2.321 . . . . 22.65 111.593 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 97.7 mt -57.82 -45.23 87.29 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 O-C-N 118.042 -2.911 . . . . 21.51 112.397 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.417 ' NE2' ' OD1' ' H' ' 243' ' ' ASP . 47.4 tp60 -63.24 -44.46 95.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.789 0.804 . . . . 53.83 111.354 -178.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . 0.417 ' HZ3' ' HG3' ' H' ' 240' ' ' LYS . 0.0 OUTLIER -57.86 -45.77 85.79 Favored 'General case' 0 C--O 1.245 0.839 0 CA-C-N 114.723 -1.126 . . . . 72.05 110.215 -179.527 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.34 -47.9 90.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 122.192 0.996 . . . . 25.07 111.476 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 25.9 mt -67.17 -36.41 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 117.557 -1.657 . . . . 39.11 108.099 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . 0.417 ' OD1' ' NE2' ' H' ' 239' ' ' GLN . 80.4 m-20 -67.73 -40.24 84.23 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.224 -0.991 . . . . 49.99 112.491 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.627 ' HG2' ' CE1' ' H' ' 245' ' ' PHE . 0.1 OUTLIER -86.35 -21.22 27.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 123.936 1.827 . . . . 85.3 110.166 -173.829 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 0.627 ' CE1' ' HG2' ' H' ' 244' ' ' GLN . 19.5 m-85 . . . . . 0 N--CA 1.465 0.308 0 O-C-N 120.63 -1.294 . . . . 58.99 109.243 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t0 . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 122.531 1.158 . . . . 79.38 110.499 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -79.96 132.64 36.08 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 119.242 -0.983 . . . . 46.33 112.357 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -65.52 153.29 41.87 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 106.123 -1.806 . . . . 43.75 106.123 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.96 127.68 24.62 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 130.603 3.561 . . . . 52.55 112.288 175.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 59' ' ' ILE . . . . . 0.406 HD13 HG21 ' I' ' 59' ' ' ILE . 15.9 pt -104.11 143.98 27.76 Favored Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 117.889 -1.524 . . . . 51.75 108.201 177.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 60' ' ' PRO . . . . . 0.545 ' HB2' ' OE2' ' I' ' 62' ' ' GLU . 89.3 Cg_exo -48.31 127.55 15.73 Favored 'Trans proline' 0 C--N 1.326 -0.656 0 O-C-N 125.634 2.386 . . . . 52.49 111.594 -177.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . . . -45.5 -33.41 2.69 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.728 -1.124 . . . . 50.02 113.086 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 62' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' I' ' 60' ' ' PRO . 0.0 OUTLIER -61.48 -18.39 58.8 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 117.378 -1.729 . . . . 60.72 111.0 -177.76 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 63' ' ' TYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 1800 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 1801 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 1900 ' ' BEN . . . . . 0.689 ' H6 ' ' O ' ' H' ' 171' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2139 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2146 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2149 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2164 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2166 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2169 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2173 ' ' HOH . . . . . 0.562 ' O ' ' HG2' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L 2174 ' ' HOH . . . . . 0.541 ' O ' ' HD3' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L 2181 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2184 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2186 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2187 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2188 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L 2189 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2042 ' ' HOH . . . . . 0.635 ' O ' ' HB2' ' H' ' 164' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2047 ' ' HOH . . . . . 0.743 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2100 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2105 ' ' HOH . . . . . 0.428 ' O ' ' NH2' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2123 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2124 ' ' HOH . . . . . 0.48 ' O ' ' HD3' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H 2125 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2126 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2130 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2132 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2133 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2134 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2135 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2136 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2137 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2138 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2140 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2141 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2142 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2143 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2144 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2145 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2147 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2148 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2150 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2151 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2152 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2153 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2154 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2155 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2156 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2157 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2158 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2159 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2160 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2161 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2162 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2163 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2165 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2167 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2168 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2170 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2171 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2172 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2175 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2176 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2177 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2178 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2182 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2183 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H 2185 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 2179 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I 2180 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' C GLU . . . . . 0.73 ' HB2' ' HB3' ' L' ' 1' ' ' CYS . 28.1 mm-40 . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.01 0.434 . . . . 99.239999999999995 111.079 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . . . . . . . . . . . -49.95 -42.45 48.61 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 117.47 -1.252 . . . . 67.420000000000002 112.229 -175.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . . . . . . . . . 32.7 t0 -107.1 11.65 29.35 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 128.209 2.604 . . . . 68.829999999999998 113.074 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . 0.73 ' HB3' ' HB2' ' L' ' 1' C GLU . 29.2 p -56.54 150.78 14.71 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 118.477 -1.289 . . . . 19.09 113.662 -179.423 66.186 79.157 98.416 106.719 2.086 104.02 -60.396 -56.824 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.6 7.95 75.29 Favored Glycine 0 CA--C 1.507 -0.413 0 O-C-N 126.604 2.44 . . . . 11.029999999999999 114.468 168.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 61.9 mt -115.21 110.39 19.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 123.796 1.76 . . . . 19.850000000000001 108.04 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -83.36 133.16 47.91 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 115.761 -2.066 . . . . 12.34 112.629 -170.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -52.35 -37.91 72.39 Favored 'Trans proline' 0 C--O 1.261 1.669 0 O-C-N 126.718 2.957 . . . . 15.17 112.594 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.24 3.32 54.7 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 124.024 3.102 . . . . 35.530000000000001 110.154 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 74.6 m-85 -135.57 -90.73 0.3 Allowed 'General case' 0 C--N 1.363 1.168 0 CA-C-O 117.251 -1.357 . . . . 16.5 109.867 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 39.1 mp0 -53.15 -37.47 61.88 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.895 1.679 . . . . 14.98 112.662 -178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . . . . . . . . . 41.5 mttt -70.33 -20.45 62.99 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 114.239 -2.791 . . . . 60.880000000000003 110.641 -173.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt -106.96 5.02 27.82 Favored 'General case' 0 C--N 1.31 -1.137 0 O-C-N 127.458 2.974 . . . . 39.079999999999998 113.26 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . . 1.7 t 50.41 40.56 23.22 Favored 'General case' 0 C--O 1.252 1.187 0 CA-C-O 124.341 2.02 . . . . 23.93 115.454 -170.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.76 134.61 50.47 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 114.613 -1.176 . . . . 21.489999999999998 108.87 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -98.28 147.94 24.14 Favored 'General case' 0 C--O 1.248 1.024 0 CA-C-O 123.93 1.824 . . . . 49.039999999999999 108.971 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -81.49 171.53 14.6 Favored 'General case' 0 C--O 1.239 0.514 0 O-C-N 120.355 -1.465 . . . . 15.08 109.755 173.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . . . . . . . . . 67.6 mttt -73.44 -14.91 61.34 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 114.929 1.455 . . . . 45.119999999999997 114.929 -169.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . . . . . . . . . 71.0 p -128.44 4.85 5.67 Favored 'General case' 0 C--O 1.25 1.108 0 O-C-N 117.787 -3.071 . . . . 17.890000000000001 112.591 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . . . . . . . . . 10.3 pt-20 -62.4 -25.18 67.8 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 122.223 2.283 . . . . 17.260000000000002 111.083 -177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 0.562 ' HG2' ' O ' ' L' 2173 ' ' HOH . 4.0 mmt85 -72.94 -23.18 60.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 113.973 -3.091 . . . . 56.670000000000002 111.505 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . . . . . . . . . 82.6 tt0 -55.22 -40.28 70.64 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 121.363 1.892 . . . . 25.489999999999998 110.917 168.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . . . . . . . . . 23.7 mt -67.45 -48.81 66.16 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 115.371 -2.532 . . . . 16.960000000000001 112.801 177.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.93 -40.89 73.8 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-O 123.388 1.566 . . . . 22.800000000000001 111.636 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . . . . . . . . . 95.2 mt-10 -66.27 -22.29 66.3 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 111.857 -2.428 . . . . 31.43 112.554 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . . . . . . . . . 52.0 p -82.04 -9.53 59.52 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 125.147 1.529 . . . . 15.119999999999999 111.9 177.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . . . . . . . . . 15.7 m-30 -91.92 72.4 5.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 124.411 2.053 . . . . 18.920000000000002 108.568 -175.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 111.872 -2.422 . . . . 58.909999999999997 110.165 -169.404 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . . . . . . . . . 23.6 mm . . . . . 0 C--O 1.243 0.731 0 CA-C-O 120.487 0.184 . . . . 20.93 110.99 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 20.0 t -100.89 126.46 54.6 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 124.634 1.174 . . . . 25.640000000000001 109.632 -179.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.686 ' OE1' ' HD3' ' H' ' 187' ' ' ARG . 3.3 mm-40 63.53 32.4 14.2 Favored 'General case' 0 N--CA 1.434 -1.232 0 C-N-CA 123.608 0.763 . . . . 60.049999999999997 112.945 176.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.7 -172.48 39.42 Favored Glycine 0 C--O 1.241 0.576 0 O-C-N 125.64 1.837 . . . . 22.050000000000001 111.73 171.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 3.2 p -129.71 168.33 16.68 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 124.41 2.052 . . . . 35.490000000000002 111.196 172.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -64.66 137.52 57.87 Favored 'General case' 0 N--CA 1.444 -0.767 1 O-C-N 116.2 -4.063 . . . . 38.920000000000002 110.522 176.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 155.18 39.54 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 117.047 -1.861 . . . . 19.469999999999999 109.801 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -71.86 155.54 40.29 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.84 -1.163 . . . . 23.710000000000001 112.47 161.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 32.3 mm -62.07 132.83 27.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.709 0 O-C-N 119.92 -1.738 . . . . 21.420000000000002 111.868 176.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 67.04 12.96 61.15 Favored Glycine 0 N--CA 1.442 -0.909 0 O-C-N 119.622 -1.924 . . . . 16.370000000000001 115.626 -176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 4.3 ttt -71.7 -24.38 61.81 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 120.293 2.047 . . . . 18.690000000000001 113.769 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . . 24.9 t -137.72 66.05 48.05 Favored Pre-proline 0 C--O 1.253 1.267 0 O-C-N 124.855 1.347 . . . . 12.550000000000001 107.868 -176.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -72.08 -4.72 15.7 Favored 'Trans proline' 0 C--O 1.247 0.966 0 C-N-CA 123.309 2.673 . . . . 13.6 114.805 -171.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . 0.442 ' CG ' ' HB ' ' H' ' 121' ' ' VAL . 2.8 p90 -93.5 -4.11 51.71 Favored 'General case' 0 C--N 1.36 1.034 0 O-C-N 119.824 -1.798 . . . . 12.85 110.392 173.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -68.73 135.67 51.64 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 121.146 1.794 . . . . 30.280000000000001 111.07 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . 0.453 ' CG1' HG22 ' H' ' 66' ' ' VAL . 79.7 t -124.2 142.16 41.91 Favored 'Isoleucine or valine' 0 C--O 1.248 0.986 0 N-CA-C 106.091 -1.818 . . . . 13.92 106.091 -179.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . 0.479 ' HB2' ' CZ3' ' H' ' 141' ' ' TRP . 42.1 ttm -107.69 124.08 49.46 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 107.477 -1.305 . . . . 19.059999999999999 107.477 172.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.01 122.65 31.15 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.413 -1.329 . . . . 35.479999999999997 107.413 171.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . 0.537 ' CZ ' ' HB3' ' H' ' 38' ' ' GLN . 41.8 t80 -122.7 126.63 47.93 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 117.37 -1.3 . . . . 31.579999999999998 109.467 -167.465 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.631 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 11.2 ttt180 -73.55 128.54 35.77 Favored 'General case' 0 C--O 1.241 0.652 0 O-C-N 128.274 3.484 . . . . 48.960000000000001 107.628 176.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -72.24 -36.42 69.08 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 124.475 1.109 . . . . 44.93 113.272 -176.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.9 OUTLIER -159.45 108.91 1.5 Allowed Pre-proline 0 N--CA 1.47 0.547 0 N-CA-C 107.5 -1.296 . . . . 57.299999999999997 107.5 -173.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -74.4 144.48 81.11 Favored 'Cis proline' 0 C--N 1.327 -0.585 0 O-C-N 123.435 1.229 . . . . 39.770000000000003 112.201 -3.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.631 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 25.7 mt-30 -60.79 124.89 21.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 124.701 2.191 . . . . 55.770000000000003 110.621 178.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.583 ' HG2' ' HB3' ' H' ' 35' ' ' ARG . 17.8 pt-20 -166.14 157.78 13.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 119.602 -1.937 . . . . 51.009999999999998 109.968 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . 0.443 ' CD1' ' HG3' ' H' ' 32' ' ' MET . 65.1 tp -57.42 133.15 54.93 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 125.151 1.532 . . . . 30.66 109.768 168.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.94 -46.64 4.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 126.198 2.904 . . . . 40.329999999999998 108.853 170.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 1.7 m -167.07 171.49 10.97 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 119.607 -1.933 . . . . 21.0 109.367 -171.433 -90.565 -154.778 -88.103 104.188 2.053 100.374 -84.571 -75.113 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -90.63 174.72 39.88 Favored Glycine 0 C--O 1.261 1.825 0 O-C-N 126.885 2.616 . . . . 14.890000000000001 109.626 167.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . -177.39 174.38 1.6 Allowed 'General case' 0 C--O 1.246 0.874 0 CA-C-O 116.975 -1.488 . . . . 13.220000000000001 108.058 -173.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 82.6 p -142.67 150.12 39.77 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 127.205 2.816 . . . . 13.130000000000001 108.145 -176.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 25.3 tp -88.51 121.16 30.59 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 119.945 -1.722 . . . . 14.869999999999999 113.353 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . . 46.0 pt -113.86 -4.49 11.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 117.343 -1.743 . . . . 15.69 113.293 -178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 23.0 p -167.86 -179.28 4.15 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 126.842 2.589 . . . . 20.239999999999998 107.902 173.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -71.71 -6.01 38.05 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 115.621 -2.432 . . . . 39.579999999999998 113.315 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 0.649 ' HD3' ' HD3' ' H' ' 111' ' ' PRO . 3.3 mmm180 -135.69 6.52 3.21 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 120.999 1.727 . . . . 55.149999999999999 112.967 176.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -123.21 135.35 54.26 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 116.857 -1.544 . . . . 26.609999999999999 110.745 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 97.7 t -122.66 133.75 67.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.191 0 O-C-N 126.5 2.375 . . . . 16.77 108.446 179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 21.2 tp -104.27 132.95 49.97 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 127.124 2.17 . . . . 15.09 108.838 -178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 7.2 t -148.71 -174.81 4.71 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-O 115.969 -1.967 . . . . 15.119999999999999 110.224 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.66 137.25 32.62 Favored 'General case' 0 C--N 1.315 -0.896 1 O-C-N 129.535 4.272 . . . . 14.970000000000001 107.961 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.76 -40.69 69.63 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 125.881 1.988 . . . . 15.539999999999999 111.388 173.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -66.18 -18.25 65.23 Favored 'General case' 0 C--O 1.261 1.683 0 CA-C-N 120.649 1.568 . . . . 21.370000000000001 112.215 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 56.5 m -66.33 -24.78 66.58 Favored 'General case' 0 C--O 1.246 0.888 0 CA-C-O 121.51 0.671 . . . . 19.530000000000001 111.336 174.416 -75.113 -84.571 -88.103 100.374 2.053 104.188 -154.778 -90.565 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 28.0 mt -109.02 -39.14 5.38 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 116.383 -1.77 . . . . 23.27 110.97 -173.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 52.7 tp -132.88 110.28 10.2 Favored 'General case' 0 CA--C 1.505 -0.772 0 O-C-N 127.269 2.856 . . . . 22.100000000000001 111.575 -174.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . . . . . . . . . 34.2 t80 -150.2 83.51 6.04 Favored Pre-proline 0 C--O 1.238 0.457 0 CA-C-O 122.851 1.31 . . . . 24.309999999999999 107.698 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . . . . . . . . . 84.2 Cg_exo -53.06 -36.47 76.42 Favored 'Trans proline' 0 C--O 1.268 2.011 0 CA-C-O 116.045 -1.731 . . . . 20.699999999999999 115.397 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . . . . . . . . . 85.7 Cg_exo -54.85 -28.81 60.11 Favored 'Trans proline' 0 C--N 1.303 -1.818 0 CA-C-N 126.791 3.461 . . . . 26.27 111.852 179.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . . . . . . . . . 46.2 m0 -106.7 21.53 17.34 Favored 'General case' 0 C--O 1.25 1.08 0 C-N-CA 119.063 -1.055 . . . . 50.909999999999997 110.891 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . . 72.6 m-20 52.02 37.69 21.93 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 120.392 1.451 . . . . 57.259999999999998 112.66 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . . . . . . . . . 2.6 ttmm -104.62 128.01 52.53 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 117.44 -1.704 . . . . 57.969999999999999 108.744 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.08 87.92 0.58 Allowed 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 129.102 2.961 . . . . 79.349999999999994 107.879 -176.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . . . . . . . . . 82.4 m-85 -94.19 147.35 23.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 117.633 -1.627 . . . . 36.100000000000001 109.879 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . . . . . . . . . 11.5 t -107.4 168.14 9.44 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 107.528 -1.286 . . . . 58.590000000000003 107.528 170.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -48.37 -45.99 36.37 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 126.056 2.097 . . . . 34.969999999999999 113.036 -178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -75.36 -7.22 53.41 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 118.475 -1.29 . . . . 53.68 112.795 -171.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -75.92 -14.36 60.26 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-O 118.124 -0.941 . . . . 49.229999999999997 112.449 176.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mt -133.79 159.44 40.61 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 117.423 2.379 . . . . 36.93 117.423 -163.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . . . . . . . . . 67.6 mt -127.95 151.76 48.72 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 113.335 -1.757 . . . . 26.460000000000001 111.12 168.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . 0.608 HG23 ' HB2' ' H' ' 83' ' ' SER . 1.2 t -110.88 136.39 47.08 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 N-CA-C 107.249 -1.389 . . . . 33.43 107.249 170.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -118.43 122.06 41.83 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.162 -1.421 . . . . 23.199999999999999 107.162 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 29.3 mt -120.15 144.74 27.92 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 O-C-N 124.945 1.403 . . . . 23.350000000000001 110.567 -168.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . . . . . . . . . . . 91.44 6.33 66.27 Favored Glycine 0 N--CA 1.441 -0.986 0 CA-C-O 124.164 1.98 . . . . 18.329999999999998 112.48 -179.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -85.48 157.28 20.49 Favored 'General case' 0 N--CA 1.433 -1.305 1 O-C-N 115.873 -4.31 . . . . 19.91 112.929 -169.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -128.48 -62.5 1.03 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 113.02 -1.9 . . . . 20.550000000000001 112.143 170.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . . . . . . . . . 14.2 t -64.76 141.73 58.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 119.712 -1.868 . . . . 27.07 109.593 175.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . 0.526 ' CZ ' ' HB2' ' H' ' 151' ' ' GLN . 63.4 ttp85 -68.5 -53.28 24.23 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 120.135 -0.626 . . . . 36.359999999999999 111.645 176.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . . . . . . . . . 31.7 p -94.66 -26.5 16.3 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.486 -0.886 . . . . 35.560000000000002 113.102 -166.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . . . . . . . . . . . -77.29 153.0 34.31 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 116.793 -1.963 . . . . 42.810000000000002 111.901 -170.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -84.34 112.22 20.12 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.739 -1.578 . . . . 32.159999999999997 106.739 170.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . 0.552 ' HB3' HG23 ' H' ' 79' ' ' ILE . 50.8 mt-10 -97.0 79.17 2.85 Favored 'General case' 0 N--CA 1.479 1.017 1 CA-C-O 131.301 5.334 . . . . 22.280000000000001 110.61 -169.564 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.411 ' O ' ' HB2' ' H' ' 78' ' ' ASN . 24.7 ttp85 -49.24 129.83 18.64 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 109.604 -3.453 . . . . 26.68 113.84 175.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' H' ' 77' A ARG . 31.8 m-20 76.09 11.35 2.97 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 126.798 2.561 . . . . 24.920000000000002 112.934 175.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . 0.743 HD11 ' O ' ' H' 2047 ' ' HOH . 98.1 mt -136.4 -63.6 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 113.883 -1.508 . . . . 21.460000000000001 111.187 -174.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.48 157.74 28.73 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 127.3 2.875 . . . . 23.32 111.522 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . 0.442 ' HE2' ' HB3' ' H' ' 81' ' ' LYS . 1.8 mmmm -125.67 144.16 50.72 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 107.322 -1.362 . . . . 41.520000000000003 107.322 170.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 17.9 mt -116.87 127.73 74.42 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.778 0 O-C-N 125.113 1.508 . . . . 36.509999999999998 109.686 -176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . 0.608 ' HB2' HG23 ' H' ' 66' ' ' VAL . 45.0 m -126.07 141.6 51.88 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.615 -1.303 . . . . 31.239999999999998 110.507 -170.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . 0.498 ' CE ' ' HD2' ' H' ' 109' ' ' LYS . 4.5 mtm -91.4 151.86 20.65 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-O 125.651 2.643 . . . . 45.420000000000002 110.847 174.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.44 HD12 ' HB3' ' H' ' 106' ' ' MET . 2.9 mm? -92.97 138.01 31.86 Favored 'General case' 0 C--N 1.354 0.784 0 O-C-N 119.069 -2.269 . . . . 28.190000000000001 114.425 -178.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . 0.448 ' OE2' ' NH2' ' H' ' 50' ' ' ARG . 33.1 tt0 -87.47 -40.64 14.16 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 123.263 1.506 . . . . 68.299999999999997 109.217 173.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -164.07 140.05 6.34 Favored 'General case' 0 C--O 1.237 0.43 0 O-C-N 117.478 -3.263 . . . . 57.049999999999997 111.368 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . . . . . . . . . 41.8 mt -103.6 139.34 24.83 Favored 'Isoleucine or valine' 0 C--O 1.249 1.043 0 CA-C-O 116.778 -1.582 . . . . 28.239999999999998 108.173 176.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -124.43 113.62 18.4 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.771 1.294 . . . . 39.600000000000001 108.795 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . . . . . . . . . 70.0 mt -102.77 139.01 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 O-C-N 126.114 2.134 . . . . 35.770000000000003 109.033 177.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . 0.789 ' HD2' ' H ' ' H' ' 93' ' ' ARG . 4.7 t60 -50.26 130.07 24.37 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 119.542 -0.863 . . . . 19.739999999999998 112.556 173.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.89 -23.36 62.15 Favored 'Trans proline' 0 N--CA 1.476 0.472 0 O-C-N 127.187 3.204 . . . . 28.059999999999999 114.229 -176.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . 0.789 ' H ' ' HD2' ' H' ' 91' ' ' HIS . 75.6 mtp180 -109.54 20.01 18.64 Favored 'General case' 0 N--CA 1.442 -0.863 0 O-C-N 118.963 -2.335 . . . . 32.380000000000003 113.358 177.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -53.11 120.53 6.03 Favored 'General case' 0 C--O 1.257 1.471 0 CA-C-O 117.057 -1.449 . . . . 19.07 111.543 165.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -100.66 81.24 2.28 Favored 'General case' 0 C--N 1.315 -0.896 0 O-C-N 125.624 1.828 . . . . 25.010000000000002 113.515 -179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -72.43 -19.33 61.6 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.82 -1.082 . . . . 22.870000000000001 112.299 173.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 92.0 mtt-85 -73.05 -33.58 65.77 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 116.968 -1.893 . . . . 34.310000000000002 110.878 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . . . . . . . . . 18.6 tt0 -117.96 -70.92 0.76 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 115.745 1.758 . . . . 43.490000000000002 115.745 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . . . . . . . . . 26.7 p30 -132.32 10.83 4.51 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 118.606 -1.237 . . . . 18.93 112.193 -169.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt 66.31 28.44 9.85 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 123.527 1.632 . . . . 19.600000000000001 112.13 -178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -59.3 138.62 57.56 Favored 'General case' 0 C--O 1.249 1.067 0 O-C-N 119.15 -2.219 . . . . 20.210000000000001 112.327 172.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 mtt85 62.63 48.37 4.37 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 124.863 1.265 . . . . 31.850000000000001 110.683 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -82.07 81.59 7.96 Favored 'General case' 0 C--O 1.25 1.123 0 N-CA-C 108.263 -1.014 . . . . 13.76 108.263 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . . . . . . . . . 21.3 tt -150.53 144.94 17.12 Favored 'Isoleucine or valine' 0 C--O 1.246 0.879 0 C-N-CA 118.292 -1.363 . . . . 14.460000000000001 109.433 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -148.18 146.6 28.79 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 126.149 1.78 . . . . 16.390000000000001 108.509 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 17.6 mt -109.83 148.39 31.59 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 124.298 0.999 . . . . 20.34 112.61 165.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.44 ' HB3' HD12 ' H' ' 85' ' ' LEU . 57.3 mtm -123.5 129.17 50.83 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 126.335 2.272 . . . . 25.890000000000001 107.005 174.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . . . . . . . . . 28.6 tttp -95.61 124.41 39.62 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.245 -1.02 . . . . 37.280000000000001 108.245 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 18.4 mt -81.1 150.96 28.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 122.41 1.1 . . . . 26.300000000000001 111.331 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . 0.498 ' HD2' ' CE ' ' H' ' 84' ' ' MET . 6.0 ttmt -62.61 -37.83 87.8 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 112.601 -2.09 . . . . 64.329999999999998 111.512 179.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . . . . . . . . . 43.4 mttt -140.15 147.11 49.04 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 115.192 -0.913 . . . . 53.840000000000003 110.497 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 0.649 ' HD3' ' HD3' ' H' ' 50' ' ' ARG . 31.3 Cg_endo -60.48 144.68 99.54 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 125.249 2.184 . . . . 41.359999999999999 111.109 177.255 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . . . . . . . . . 8.6 p -91.58 143.64 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 107.278 -1.378 . . . . 28.010000000000002 107.278 175.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -82.86 134.27 35.1 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 125.481 1.738 . . . . 28.379999999999999 110.276 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -77.54 155.42 31.61 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 125.454 1.721 . . . . 23.699999999999999 106.665 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . . . . . . . . . 29.1 p -154.36 -170.66 3.61 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 124.312 1.008 . . . . 16.16 110.288 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -58.72 -24.52 61.66 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 123.455 1.598 . . . . 20.550000000000001 111.643 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -111.92 -8.07 14.12 Favored 'General case' 0 C--O 1.245 0.83 0 O-C-N 119.51 -1.994 . . . . 22.149999999999999 111.54 -167.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 40.2 mt -131.56 109.5 15.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 C-N-CA 125.985 1.714 . . . . 19.379999999999999 110.6 -173.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -158.31 140.31 10.1 Favored Pre-proline 0 C--N 1.361 1.108 0 CA-C-O 114.675 -2.583 . . . . 17.370000000000001 111.438 -177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -76.58 152.77 33.89 Favored 'Trans proline' 0 C--N 1.314 -1.288 0 O-C-N 124.371 1.721 . . . . 20.34 112.227 -172.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' H' ' 29' ' ' TRP . 5.5 p -89.67 158.91 2.92 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 113.533 -1.667 . . . . 12.59 110.119 171.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 62.7 m -88.43 151.54 22.5 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.223 -0.923 . . . . 13.890000000000001 110.448 176.815 -56.824 -60.396 98.416 104.02 2.086 106.719 79.157 66.186 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -100.87 144.2 28.06 Favored Pre-proline 0 N--CA 1.465 0.289 0 O-C-N 125.742 1.901 . . . . 25.260000000000002 108.409 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -69.36 145.26 58.89 Favored 'Trans proline' 0 C--O 1.217 -0.558 0 N-CA-C 115.488 1.303 . . . . 19.359999999999999 115.488 -176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -85.61 162.98 18.6 Favored 'General case' 0 N--CA 1.439 -0.983 0 O-C-N 127.081 2.738 . . . . 37.710000000000001 107.316 163.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -54.06 -39.01 65.87 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 119.045 -2.285 . . . . 52.009999999999998 113.098 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -73.25 -41.77 63.31 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 118.957 -1.097 . . . . 33.670000000000002 110.789 -173.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 85.9 m -62.34 -40.44 96.37 Favored 'General case' 0 C--O 1.244 0.801 0 C-N-CA 118.445 -1.302 . . . . 21.52 111.711 174.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.25 -42.01 99.14 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 117.625 -3.172 . . . . 19.780000000000001 111.366 179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -62.8 -38.92 92.59 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-O 124.37 2.033 . . . . 20.469999999999999 111.584 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 56.9 p -75.06 -38.06 61.47 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 123.781 1.753 . . . . 42.840000000000003 113.555 -175.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 21.8 mt -95.06 -23.64 17.25 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 116.429 2.011 . . . . 27.300000000000001 116.429 -172.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.11 75.63 8.64 Favored 'General case' 0 C--O 1.245 0.861 0 C-N-CA 117.334 -1.746 . . . . 36.280000000000001 111.926 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -129.71 141.32 50.91 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.773 1.296 . . . . 33.640000000000001 110.784 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -50.97 134.19 26.24 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 115.991 -1.957 . . . . 21.850000000000001 112.426 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 92.3 -24.51 22.07 Favored Glycine 0 N--CA 1.445 -0.742 0 O-C-N 125.352 1.657 . . . . 17.809999999999999 112.404 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -71.59 137.07 47.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 118.352 -1.339 . . . . 31.870000000000001 109.01 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 81.7 mttt -97.54 143.79 27.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.566 -0.454 . . . . 17.670000000000002 111.767 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -119.88 -177.59 16.2 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.495 -1.442 . . . . 12.58 109.495 166.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -129.91 132.38 46.35 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 126.541 1.965 . . . . 12.960000000000001 108.37 -173.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 16.1 m -117.07 141.31 36.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 C-N-CA 118.134 -1.427 . . . . 12.68 108.975 176.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . . . . . . . . . 6.6 p -135.32 149.09 49.67 Favored 'General case' 0 C--N 1.316 -0.853 0 O-C-N 124.958 1.411 . . . . 15.1 109.22 -171.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 176.34 168.93 37.17 Favored Glycine 0 N--CA 1.48 1.587 0 C-N-CA 115.351 -3.309 . . . . 14.65 110.498 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . 0.479 ' CZ3' ' HB2' ' H' ' 32' ' ' MET . 24.6 m-90 -104.83 23.84 12.83 Favored 'General case' 0 C--O 1.242 0.706 0 O-C-N 126.491 1.936 . . . . 21.289999999999999 112.591 175.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -80.6 -179.02 52.59 Favored Glycine 0 CA--C 1.509 -0.329 0 C-N-CA 118.535 -1.793 . . . . 21.829999999999998 114.182 -176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . 0.727 ' ND2' ' HB3' ' H' ' 192' ' ' GLU . 63.7 m-20 -46.51 139.8 4.77 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 116.871 2.174 . . . . 53.600000000000001 116.871 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.74 -10.91 59.93 Favored 'General case' 0 N--CA 1.443 -0.782 0 CA-C-O 123.321 1.534 . . . . 31.460000000000001 112.385 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . . . . -162.68 160.37 25.53 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 117.8 -1.56 . . . . 49.939999999999998 108.713 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--N 1.323 -0.566 0 O-C-N 124.843 1.34 . . . . 50.490000000000002 111.149 178.907 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.485 0 CA-C-O 119.307 -0.718 . . . . 52.950000000000003 111.767 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 0.526 ' HB2' ' CZ ' ' H' ' 73' ' ' ARG . 0.0 OUTLIER -110.71 141.85 24.93 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.444 -0.947 . . . . 57.479999999999997 108.444 178.4 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -75.71 154.75 39.46 Favored 'Trans proline' 0 C--N 1.326 -0.649 0 C-N-CA 122.202 1.934 . . . . 30.75 113.677 -173.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 5.9 t -74.85 -31.9 61.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 114.829 -1.078 . . . . 33.670000000000002 110.64 175.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . . . . . . . . . 12.6 m -138.39 164.96 25.97 Favored 'Isoleucine or valine' 0 C--N 1.349 0.568 0 CA-C-O 118.535 -0.745 . . . . 21.379999999999999 112.132 -177.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 24.2 tp -50.68 136.4 21.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 125.955 2.788 . . . . 18.100000000000001 111.482 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . . . . . . . . . 88.4 mm-40 -107.97 150.24 27.36 Favored 'General case' 0 C--O 1.211 -0.955 0 O-C-N 120.17 -1.581 . . . . 19.079999999999998 111.0 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . . . . . . . . . 5.9 p -133.13 144.34 36.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 O-C-N 126.413 2.32 . . . . 26.960000000000001 108.508 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.86 142.76 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 121.303 1.865 . . . . 18.780000000000001 107.667 173.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -105.15 132.22 51.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 107.663 -1.236 . . . . 21.699999999999999 107.663 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 95.7 mt -139.44 137.17 18.52 Favored Pre-proline 0 C--O 1.246 0.913 0 O-C-N 124.293 0.996 . . . . 16.559999999999999 109.579 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -80.58 139.51 12.73 Favored 'Trans proline' 0 C--O 1.246 0.88 0 C-N-CA 121.548 1.499 . . . . 14.279999999999999 114.469 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 75.6 mt -62.22 142.31 16.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 107.617 -1.253 . . . . 13.859999999999999 107.617 173.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 79.1 t -107.57 148.43 11.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 125.284 1.615 . . . . 15.789999999999999 112.361 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . 0.635 ' HB2' ' O ' ' H' 2042 ' ' HOH . 0.0 OUTLIER -59.21 136.89 58.1 Favored 'General case' 0 C--O 1.24 0.6 0 CA-C-N 114.231 -1.349 . . . . 64.040000000000006 112.949 178.118 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.428 ' NH2' ' O ' ' H' 2105 ' ' HOH . 13.1 ttt85 -52.24 -39.8 68.17 Favored Pre-proline 0 C--O 1.252 1.216 0 CA-C-O 112.745 -3.502 . . . . 60.75 112.684 -175.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' H' ' 164' ' ' GLU . 13.4 Cg_exo -69.69 -31.61 20.52 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 CA-C-N 125.044 2.837 . . . . 24.800000000000001 111.385 -178.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 96.6 t -68.24 -44.3 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 O-C-N 118.763 -2.461 . . . . 21.760000000000002 108.025 177.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . . 99.0 m -55.88 -52.92 62.4 Favored 'General case' 0 C--N 1.343 0.295 0 O-C-N 124.424 1.077 . . . . 16.920000000000002 110.907 174.948 -65.431 -62.946 -93.053 105.142 2.018 103.285 -79.426 92.719 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . 0.406 ' NZ ' ' NH1' ' H' ' 165' ' ' ARG . 77.2 mttt -61.22 -42.24 98.26 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 119.948 -0.701 . . . . 39.159999999999997 112.137 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -74.24 -4.6 36.99 Favored 'General case' 0 C--O 1.247 0.959 0 N-CA-C 114.919 1.452 . . . . 20.02 114.919 -175.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . 0.689 ' O ' ' H6 ' ' H' 1900 ' ' BEN . 26.7 p -90.25 -5.81 55.92 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.965 0.906 . . . . 18.219999999999999 111.612 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . . 6.0 t -148.12 157.89 43.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 O-C-N 125.753 1.908 . . . . 15.390000000000001 110.556 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . . 56.2 mtp180 -88.08 -11.23 47.7 Favored 'General case' 0 N--CA 1.444 -0.774 0 O-C-N 124.564 1.165 . . . . 26.390000000000001 112.856 169.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 21.2 mm -71.42 142.36 15.57 Favored 'Isoleucine or valine' 0 C--O 1.256 1.413 0 N-CA-C 112.944 0.72 . . . . 26.760000000000002 112.944 177.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . . . . . . . . . 68.3 ttp85 -70.97 119.34 14.95 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 120.511 -1.368 . . . . 35.399999999999999 110.401 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . . 9.7 mm -92.16 143.81 10.59 Favored 'Isoleucine or valine' 0 C--O 1.244 0.772 0 N-CA-C 107.747 -1.205 . . . . 26.670000000000002 107.747 -178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . . . . . . . . . 27.5 p -117.1 174.75 5.94 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 120.221 -1.549 . . . . 16.920000000000002 112.533 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -68.59 -16.06 63.73 Favored 'General case' 0 N--CA 1.444 -0.766 0 O-C-N 127.272 2.858 . . . . 32.789999999999999 108.704 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -89.97 11.32 20.87 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 125.923 2.015 . . . . 19.170000000000002 110.771 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 28.3 mtt -130.8 154.72 47.72 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 126.18 1.792 . . . . 18.899999999999999 108.818 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 37.5 p90 -139.95 164.06 31.0 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 126.033 2.083 . . . . 13.25 108.637 164.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.39 158.44 34.3 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 116.765 -1.974 . . . . 15.619999999999999 109.571 179.586 92.719 -79.426 -93.053 103.285 2.018 105.142 -62.946 -65.431 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -147.76 153.06 38.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.286 -1.324 . . . . 15.08 112.63 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . . . . . . . . . . . 138.5 168.27 11.23 Favored Glycine 0 C--N 1.343 0.955 0 O-C-N 126.68 2.488 . . . . 15.77 110.728 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . . . . . . . . . 64.5 m-85 -85.7 148.87 25.67 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 125.75 1.5 . . . . 23.629999999999999 109.941 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -83.7 156.37 64.87 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 116.316 -1.802 . . . . 47.299999999999997 107.35 175.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_exo -44.95 -39.81 14.59 Favored 'Trans proline' 0 C--N 1.326 -0.612 0 O-C-N 126.631 2.911 . . . . 39.149999999999999 113.29 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . . . . . . . . . 3.9 m-20 -98.14 15.74 23.38 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 117.768 -3.082 . . . . 73.670000000000002 113.18 -174.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . . . . . . . . . 53.4 mt-10 -83.6 -8.53 59.29 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 124.574 2.13 . . . . 44.850000000000001 110.362 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 97.57 -77.81 0.64 Allowed Glycine 0 CA--C 1.524 0.651 0 C-N-CA 117.122 -2.466 . . . . 44.57 109.306 178.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . . . -59.51 158.17 10.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 124.652 2.168 . . . . 47.560000000000002 113.867 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.686 ' HD3' ' OE1' ' H' ' 18' ' ' GLU . 21.5 mtp85 -126.22 179.07 5.43 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 127.022 2.129 . . . . 39.579999999999998 112.871 -174.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 0.454 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 137.15 146.27 5.1 Favored Glycine 0 C--O 1.229 -0.195 0 C-N-CA 119.846 -1.168 . . . . 19.710000000000001 112.793 171.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -169.05 161.89 10.7 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 119.337 -0.945 . . . . 19.359999999999999 109.454 -178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.39 158.37 35.15 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 123.365 0.666 . . . . 17.780000000000001 111.734 162.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . . . . . . . . . 8.4 t -144.84 -171.94 3.73 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.449 -1.3 . . . . 28.719999999999999 110.258 175.836 -162.365 54.108 76.633 103.294 2.027 104.507 -178.961 -48.832 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . 0.727 ' HB3' ' ND2' ' H' ' 143' ' ' ASN . 26.8 tt0 -60.25 133.82 56.46 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 118.819 -2.426 . . . . 38.200000000000003 112.764 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 106.0 -26.38 20.91 Favored Glycine 0 CA--C 1.542 1.74 0 CA-C-O 116.482 -2.288 . . . . 18.07 109.276 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -86.04 -21.1 27.92 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 128.799 3.294 . . . . 18.989999999999998 113.952 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . . . . . . . . . 4.8 m -33.63 132.26 0.22 Allowed 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 115.106 1.521 . . . . 30.239999999999998 115.106 171.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.71 -10.62 73.02 Favored Glycine 0 CA--C 1.545 1.962 0 CA-C-O 115.901 -2.611 . . . . 12.48 111.596 173.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -80.26 171.81 54.39 Favored Glycine 0 C--O 1.238 0.37 0 O-C-N 127.622 2.601 . . . . 13.02 109.673 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -88.82 145.42 5.52 Favored 'Trans proline' 0 C--N 1.32 -0.968 0 N-CA-C 116.355 1.636 . . . . 15.01 116.355 -173.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -105.23 115.56 30.48 Favored 'General case' 0 C--O 1.253 1.258 0 N-CA-C 104.68 -2.341 . . . . 13.74 104.68 163.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 31.3 m -119.94 156.25 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 CA-C-O 123.523 1.63 . . . . 12.050000000000001 110.158 -172.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . . . . . . . . . 82.7 mtp -136.18 146.33 46.74 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 112.769 -2.014 . . . . 12.73 108.24 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -99.36 112.88 24.98 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.44 -0.578 . . . . 13.359999999999999 109.44 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 27.0 t -65.09 129.57 94.52 Favored Pre-proline 0 N--CA 1.473 0.677 0 C-N-CA 116.937 -1.905 . . . . 14.23 110.192 -178.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.23 -6.77 15.87 Favored 'Trans proline' 0 N--CA 1.485 1.008 0 O-C-N 126.59 2.889 . . . . 14.699999999999999 113.758 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 74.9 m-85 -86.41 -37.64 18.17 Favored 'General case' 0 C--O 1.246 0.898 0 O-C-N 127.508 3.005 . . . . 22.510000000000002 112.253 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.1 5.7 4.93 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 118.721 -1.191 . . . . 17.57 113.827 -178.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . 0.443 ' ND2' ' O ' ' H' 2066 ' ' HOH . 30.6 m120 57.94 31.74 21.01 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.822 1.249 . . . . 61.939999999999998 114.026 176.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 68.9 mtt-85 -109.84 148.22 31.91 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 123.023 0.529 . . . . 26.550000000000001 111.008 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -85.31 133.96 34.13 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 125.663 1.852 . . . . 12.279999999999999 111.003 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.82 137.3 54.07 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.312 -2.222 . . . . 14.44 111.234 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -89.42 108.29 19.56 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 117.549 -1.661 . . . . 12.49 110.681 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . . . . . . . . . 66.2 mmm -92.61 -23.53 18.99 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.277 0.473 . . . . 15.27 112.277 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' H' ' 229' ' ' THR . . . -141.98 160.82 27.16 Favored Glycine 0 C--O 1.244 0.734 0 N-CA-C 110.172 -1.171 . . . . 8.9800000000000004 110.172 -173.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 66.4 mt -119.4 130.64 73.73 Favored 'Isoleucine or valine' 0 C--O 1.261 1.66 0 CA-C-N 112.978 -1.611 . . . . 12.140000000000001 110.139 168.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 93.7 t -57.77 119.79 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 118.175 -1.41 . . . . 11.58 109.705 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . . . . . . . . . 48.1 t -118.05 -60.79 1.76 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 117.711 -1.595 . . . . 15.67 113.269 -173.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 62.6 p-90 -157.95 161.39 38.18 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 125.365 2.507 . . . . 18.280000000000001 111.843 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . . . . . . . . . . . -165.54 152.96 22.69 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 104.37 -3.492 . . . . 27.640000000000001 104.37 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . 0.787 ' HB2' ' HD2' ' H' ' 224' ' ' LYS . 45.0 mt-10 -95.03 99.46 11.46 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-O 122.995 1.379 . . . . 30.09 107.326 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . . . . . . . . . . . 79.41 -172.15 55.0 Favored Glycine 0 CA--C 1.543 1.83 0 C-N-CA 114.369 -3.777 . . . . 25.989999999999998 107.079 -173.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 24.4 m -134.8 127.62 31.2 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 107.849 -1.167 . . . . 26.73 107.849 179.659 -48.832 -178.961 76.633 104.507 2.027 103.294 54.108 -162.365 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 17.4 t0 56.81 36.93 28.41 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-O 117.284 -1.341 . . . . 27.969999999999999 112.534 175.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . 0.697 ' HB2' ' HD2' ' H' ' 224' ' ' LYS . 66.8 mtt180 -83.43 142.79 30.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 116.522 -2.071 . . . . 48.68 109.996 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -60.43 135.73 57.83 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 125.666 2.651 . . . . 57.32 110.026 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 84.73 -3.61 86.49 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 111.832 -2.44 . . . . 23.25 112.84 173.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . 0.787 ' HD2' ' HB2' ' H' ' 217' ' ' GLU . 0.0 OUTLIER -110.14 158.51 18.25 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.882 2.073 . . . . 21.879999999999999 109.072 176.47 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . 0.471 ' O ' ' HE3' ' H' ' 224' ' ' LYS . 97.4 m-85 -138.39 154.38 48.92 Favored 'General case' 0 CA--C 1.506 -0.718 0 CA-C-O 123.284 1.516 . . . . 27.239999999999998 110.706 -176.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -86.32 146.99 21.27 Favored Glycine 0 C--N 1.351 1.397 0 C-N-CA 115.789 -3.1 . . . . 12.66 109.345 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -108.75 141.67 40.41 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.094 -0.706 . . . . 16.75 109.094 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -129.79 138.97 51.33 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 112.395 -2.184 . . . . 14.369999999999999 110.21 -173.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . 0.42 ' O ' ' HA2' ' H' ' 211' ' ' GLY . 34.3 m -65.37 132.42 48.96 Favored 'General case' 0 C--O 1.251 1.149 0 O-C-N 121.021 -1.05 . . . . 11.52 109.996 172.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -84.75 99.78 11.08 Favored 'General case' 0 CA--C 1.5 -0.973 0 N-CA-C 108.513 -0.921 . . . . 13.779999999999999 108.513 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.69 -42.53 94.65 Favored 'Isoleucine or valine' 0 C--O 1.242 0.692 0 CA-C-N 119.128 0.876 . . . . 13.369999999999999 111.393 -170.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -59.64 -40.68 88.47 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 119.03 -2.294 . . . . 21.190000000000001 111.773 -178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 10.4 mmm180 -62.4 -22.73 66.38 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 118.676 -1.21 . . . . 49.210000000000001 113.102 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . . . . . . . . . 67.8 mt -107.99 13.04 26.47 Favored 'General case' 0 C--O 1.247 0.956 0 CA-C-O 123.98 1.848 . . . . 26.309999999999999 112.328 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -66.15 -32.57 74.1 Favored 'General case' 0 N--CA 1.445 -0.699 0 O-C-N 118.693 -2.504 . . . . 43.340000000000003 112.914 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . . . -58.1 -44.57 87.72 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 116.719 -1.993 . . . . 44.32 109.095 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 73.9 t90 -63.74 -43.54 96.2 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 124.974 2.321 . . . . 22.649999999999999 111.593 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 97.7 mt -57.82 -45.23 87.29 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 O-C-N 118.042 -2.911 . . . . 21.510000000000002 112.397 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.417 ' NE2' ' OD1' ' H' ' 243' ' ' ASP . 47.4 tp60 -63.24 -44.46 95.15 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.789 0.804 . . . . 53.829999999999998 111.354 -178.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . 0.417 ' HZ3' ' HG3' ' H' ' 240' ' ' LYS . 0.0 OUTLIER -57.86 -45.77 85.79 Favored 'General case' 0 C--O 1.245 0.839 0 CA-C-N 114.723 -1.126 . . . . 72.049999999999997 110.215 -179.527 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 67.9 t -62.34 -47.9 90.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 122.192 0.996 . . . . 25.07 111.476 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . . . . . . . . . 25.9 mt -67.17 -36.41 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 117.557 -1.657 . . . . 39.109999999999999 108.099 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . 0.417 ' OD1' ' NE2' ' H' ' 239' ' ' GLN . 80.4 m-20 -67.73 -40.24 84.23 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.224 -0.991 . . . . 49.990000000000002 112.491 179.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.627 ' HG2' ' CE1' ' H' ' 245' ' ' PHE . 0.1 OUTLIER -86.35 -21.22 27.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 123.936 1.827 . . . . 85.299999999999997 110.166 -173.829 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 0.627 ' CE1' ' HG2' ' H' ' 244' ' ' GLN . 19.5 m-85 . . . . . 0 N--CA 1.465 0.308 0 O-C-N 120.63 -1.294 . . . . 58.990000000000002 109.243 174.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t0 . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 122.531 1.158 . . . . 79.379999999999995 110.499 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 56' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -79.96 132.64 36.08 Favored 'General case' 0 C--O 1.224 -0.25 0 C-N-CA 119.242 -0.983 . . . . 46.329999999999998 112.357 -178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 57' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -65.52 153.29 41.87 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 106.123 -1.806 . . . . 43.75 106.123 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -52.96 127.68 24.62 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 130.603 3.561 . . . . 52.549999999999997 112.288 175.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 59' ' ' ILE . . . . . 0.406 HD13 HG21 ' I' ' 59' ' ' ILE . 15.9 pt -104.11 143.98 27.76 Favored Pre-proline 0 C--O 1.234 0.265 0 C-N-CA 117.889 -1.524 . . . . 51.75 108.201 177.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 60' ' ' PRO . . . . . 0.545 ' HB2' ' OE2' ' I' ' 62' ' ' GLU . 89.3 Cg_exo -48.31 127.55 15.73 Favored 'Trans proline' 0 C--N 1.326 -0.656 0 O-C-N 125.634 2.386 . . . . 52.490000000000002 111.594 -177.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 61' ' ' GLU . . . . . . . . . . . . . . . -45.5 -33.41 2.69 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.728 -1.124 . . . . 50.020000000000003 113.086 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 62' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' I' ' 60' ' ' PRO . 0.0 OUTLIER -61.48 -18.39 58.8 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 117.378 -1.729 . . . . 60.719999999999999 111.0 -177.76 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 63' ' ' TYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 1800 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 1801 ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 1900 ' ' BEN . . . . . 0.689 ' H6 ' ' O ' ' H' ' 171' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2127 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2129 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2139 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2146 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2149 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2164 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2166 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2169 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2173 ' ' HOH . . . . . 0.562 ' O ' ' HG2' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L 2174 ' ' HOH . . . . . 0.541 ' O ' ' HD3' ' L' ' 14' D ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L 2181 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2184 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2186 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2187 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2188 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L 2189 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2000 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2042 ' ' HOH . . . . . 0.635 ' O ' ' HB2' ' H' ' 164' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2047 ' ' HOH . . . . . 0.743 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2066 ' ' HOH . . . . . 0.443 ' O ' ' ND2' ' H' ' 205' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H 2067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2100 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2105 ' ' HOH . . . . . 0.428 ' O ' ' NH2' ' H' ' 165' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2123 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2124 ' ' HOH . . . . . 0.48 ' O ' ' HD3' ' H' ' 224' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H 2125 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2126 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2128 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2130 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2131 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2132 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2133 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2134 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2135 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2136 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2137 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2138 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2140 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2141 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2142 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2143 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2144 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2145 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2147 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2148 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2150 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2151 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2152 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2153 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2154 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2155 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2156 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2157 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2158 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2159 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2160 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2161 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2162 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2163 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2165 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2167 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2168 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2170 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2171 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2172 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2175 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2176 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2177 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2178 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2182 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2183 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H 2185 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 2179 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I 2180 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_