data_1a2c_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 1a2c _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' H THR . . . . . 0.698 ' O ' ' CD1' ' H' ' 123' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.264 1.839 0 N-CA-C 100.25 -3.982 . . . . 50.0 100.25 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' G PHE . . . . . 0.832 ' CD2' ' N ' ' L' ' 1' F GLY 0.26 22.8 p90 -67.84 -141.19 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 128.064 3.792 . . . . 50.0 114.506 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 1' F GLY . . . . . 0.832 ' N ' ' CD2' ' L' ' 1' G PHE . . . -22.86 106.88 0.01 OUTLIER Glycine 0 N--CA 1.477 1.418 1 CA-C-O 112.712 -4.382 . . . . 50.0 107.443 179.916 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 1' E SER . . . . . 0.797 ' CA ' ' O ' ' H' ' 123' ' ' LEU . 4.7 t 33.89 83.5 0.02 OUTLIER 'General case' 0 C--O 1.264 1.861 0 O-C-N 128.811 3.301 . . . . 50.0 112.758 177.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' D GLY . . . . . 0.706 ' CA ' ' O ' ' H' ' 529' ' ' HOH . . . 29.63 -143.78 0.01 OUTLIER Glycine 0 C--O 1.259 1.68 0 O-C-N 128.557 3.661 . . . . 50.0 111.374 -178.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' C GLU . . . . . 1.189 ' CG ' ' N ' ' L' ' 1' B ALA . 0.5 OUTLIER -71.21 -148.66 0.02 OUTLIER 'General case' 0 C--O 1.26 1.655 1 N-CA-C 123.761 4.726 . . . . 50.0 123.761 -174.516 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' L' L ' 1' B ALA . . . . . 1.189 ' N ' ' CG ' ' L' ' 1' C GLU . . . -101.5 -60.15 1.58 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 129.453 3.101 . . . . 48.03 107.538 -175.254 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' A ASP . . . . . 0.521 ' O ' ' NE2' ' H' ' 119' ' ' HIS . 17.0 t0 -103.91 21.92 15.47 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 110.839 -2.891 . . . . 50.0 109.584 175.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' CYS . . . . . . . . . . . . . 25.2 p -55.2 144.11 25.47 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.482 -1.287 . . . . 29.4 113.49 -173.955 67.354 79.693 96.047 102.158 2.006 104.621 -52.627 -68.329 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.46 7.9 42.54 Favored Glycine 0 C--O 1.265 2.06 1 N-CA-C 127.98 5.952 . . . . 19.21 127.98 174.044 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . 0.608 ' O ' ' CD2' ' H' ' 119' ' ' HIS . 54.6 mt -111.78 102.64 10.91 Favored 'General case' 0 C--O 1.256 1.409 0 N-CA-C 102.159 -3.275 . . . . 17.79 102.159 178.658 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' ARG . . . . . 0.64 ' NH2' ' OE2' ' L' ' 14' C GLU . 6.3 mtm180 -75.94 133.36 72.78 Favored Pre-proline 0 C--O 1.263 1.814 1 CA-C-N 106.936 -4.666 . . . . 19.0 110.455 -177.123 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.61 -33.23 96.29 Favored 'Trans proline' 0 CA--C 1.479 -2.245 0 O-C-N 128.09 3.679 . . . . 26.53 112.775 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 mp -99.85 5.63 45.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 119.896 -1.752 . . . . 26.69 115.246 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' PHE . . . . . 0.459 ' O ' ' N ' ' L' ' 12' ' ' LEU . 97.9 m-85 -134.21 -74.75 0.47 Allowed 'General case' 0 C--N 1.316 -0.861 0 O-C-N 120.865 -1.147 . . . . 26.9 111.077 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 mp0 -56.74 -58.29 8.74 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 115.376 -2.25 . . . . 26.47 110.994 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . 0.48 ' CE ' ' OD2' ' L' ' 1' A ASP . 6.4 mttt -53.84 -14.19 0.91 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 128.232 3.457 . . . . 28.06 114.994 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . 0.258 82.1 mttt -125.54 -2.72 7.36 Favored 'General case' 0 C--O 1.211 -0.937 0 CA-C-O 114.556 -2.64 . . . . 35.51 108.381 -176.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' SER . . . . . . . . . . . . 0.368 10.1 t 66.72 42.7 2.59 Favored 'General case' 0 C--O 1.267 1.995 1 O-C-N 134.443 7.34 . . . . 26.32 113.028 178.954 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' LEU . . . . . 0.459 ' N ' ' O ' ' L' ' 7' ' ' PHE . 43.1 mt -113.84 142.11 46.5 Favored 'General case' 0 C--N 1.362 1.13 0 CA-C-O 112.032 -3.842 . . . . 27.34 108.673 175.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.39 6.5 mt-10 -99.64 148.86 23.88 Favored 'General case' 0 C--O 1.251 1.178 1 CA-C-O 110.668 -4.492 . . . . 46.84 111.893 176.816 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' C ' ' L' ' 14' ' ' ASP . 5.6 p30 -84.46 163.51 19.4 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 127.045 2.716 . . . . 27.27 105.297 175.088 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' A LYS . . . . . 0.587 ' CG ' ' OE2' ' H' ' 23' ' ' GLU . 0.0 OUTLIER -60.72 -17.43 48.34 Favored 'General case' 0 C--O 1.263 1.804 1 CA-C-O 111.38 -4.152 . . . . 41.68 113.891 -171.338 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' L' L ' 14' B THR . . . . . 0.545 ' O ' ' N ' ' L' ' 14' E GLU 0.251 77.7 p -124.43 -11.31 7.39 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 114.394 -2.922 . . . . 31.81 115.584 -179.257 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' C GLU . . . . . 0.64 ' OE2' ' NH2' ' L' ' 4' ' ' ARG 0.316 31.3 mt-10 -34.44 -47.31 0.3 Allowed 'General case' 0 N--CA 1.474 0.773 0 O-C-N 124.206 0.941 . . . . 33.79 111.287 176.421 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' D ARG . . . . . 0.899 ' CD ' ' N ' ' L' ' 14' E GLU . 0.0 OUTLIER -37.74 -51.18 1.25 Allowed 'General case' 0 C--N 1.395 2.577 0 C-N-CA 114.918 -2.713 . . . . 50.0 110.075 179.061 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' L' L ' 14' E GLU . . . . . 0.899 ' N ' ' CD ' ' L' ' 14' D ARG . 10.8 tt0 -44.88 -53.47 7.51 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 111.32 -2.673 . . . . 40.66 110.455 -171.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' F LEU . . . . . 0.566 ' CD1' ' N ' ' L' ' 14' F LEU . 5.3 mp -50.39 -63.57 1.08 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-N 112.371 -2.195 . . . . 29.29 109.724 177.205 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' G LEU . . . . . 0.634 ' O ' ' CA ' ' L' ' 14' L ASP . 3.6 mm? -50.56 -45.54 57.1 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 124.901 1.376 . . . . 28.69 113.724 -178.057 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' H GLU . . . . . . . . . . . . . 92.1 mt-10 -60.63 -16.41 38.39 Favored 'General case' 0 C--N 1.296 -1.733 1 CA-C-O 110.98 -4.343 . . . . 50.0 115.732 -175.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' I SER . . . . . 0.709 ' C ' ' N ' ' L' ' 14' K ILE . 59.6 p -94.87 -29.64 14.6 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 127.931 3.27 . . . . 33.11 113.23 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' J TYR . . . . . 0.401 ' N ' ' CD1' ' L' ' 14' J TYR . 4.9 m-30 -76.29 39.46 0.2 Allowed 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 102.798 -3.038 . . . . 39.92 102.798 179.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' K ILE . . . . . 0.709 ' N ' ' C ' ' L' ' 14' I SER . 0.1 OUTLIER 29.06 48.63 0.12 Allowed 'Isoleucine or valine' 1 C--N 1.124 -9.229 2 CA-C-N 102.217 -6.81 . . . . 49.83 109.009 -158.533 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' L' L ' 14' L ASP . . . . . 1.368 ' C ' ' N ' ' L' ' 14' M GLY . 7.6 m-20 87.08 163.5 0.08 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 129.044 3.965 . . . . 50.0 109.936 -179.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 14' M GLY . . . . . 1.368 ' N ' ' C ' ' L' ' 14' L ASP . . . -70.36 -156.89 1.86 Allowed Glycine 1 C--N 1.743 23.184 2 O-C-N 97.449 -15.782 . . . . 50.0 121.084 -165.201 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' L' L ' 15' ' ' ARG . . . . . 0.492 ' OXT' ' O ' ' L' ' 14' M GLY . . . . . . . . 0 C--O 1.282 2.811 0 CA-C-O 114.415 -2.707 . . . . 50.0 108.372 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' ILE . . . . . 0.425 ' N ' ' OD2' ' H' ' 194' ' ' ASP . 33.2 mm . . . . . 0 C--O 1.261 1.678 0 N-CA-C 103.568 -2.753 . . . . 21.21 103.568 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' VAL . . . . . 0.55 ' O ' ' CA ' ' H' ' 188' ' ' GLY . 74.1 t -108.93 130.46 61.79 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 128.339 3.924 . . . . 27.37 110.143 178.682 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 60.61 49.12 6.72 Favored 'General case' 0 C--N 1.312 -1.023 1 O-C-N 115.341 -4.599 . . . . 41.48 113.615 -179.137 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.1 -175.67 14.08 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-O 116.127 -2.485 . . . . 32.73 108.191 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.92 179.98 3.9 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 118.992 1.396 . . . . 38.32 111.351 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' ASP . . . . . 0.573 ' CB ' ' CG1' ' H' ' 154' ' ' VAL . 26.5 m-20 -82.95 130.43 35.14 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 126.961 2.663 . . . . 35.52 105.51 177.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' ALA . . . . . 0.46 ' CB ' ' CG1' ' H' ' 157' ' ' VAL . . . -60.33 147.74 39.44 Favored 'General case' 0 C--N 1.279 -2.474 0 O-C-N 128.493 3.621 . . . . 29.58 109.974 178.551 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' GLU . . . . . 0.587 ' OE2' ' CG ' ' L' ' 14' A LYS . 22.4 mt-10 -70.55 159.1 34.94 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-N 121.897 2.135 . . . . 32.7 110.423 170.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mm -65.37 139.11 21.9 Favored 'Isoleucine or valine' 0 C--O 1.259 1.587 0 N-CA-C 103.164 -2.902 . . . . 21.89 103.164 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 50.21 34.19 24.57 Favored Glycine 0 N--CA 1.421 -2.304 1 C-N-CA 137.641 7.305 . . . . 18.4 112.75 -174.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 5.0 ttt -79.84 -21.41 44.2 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 127.457 2.303 . . . . 24.71 111.624 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.253 0.2 OUTLIER -137.61 65.02 46.44 Favored Pre-proline 0 C--N 1.317 -0.815 0 C-N-CA 127.632 2.373 . . . . 26.28 111.763 -179.392 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 28' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -60.81 -12.23 21.06 Favored 'Trans proline' 0 C--O 1.27 2.093 0 C-N-CA 122.095 1.864 . . . . 17.65 113.799 -177.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -99.56 -2.32 36.03 Favored 'General case' 0 C--O 1.269 2.095 0 CA-C-O 116.562 -1.685 . . . . 18.05 113.307 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 30' ' ' GLN . . . . . 0.608 ' OE1' ' OG1' ' H' ' 139' ' ' THR . 64.3 tp60 -72.31 121.38 19.36 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 129.103 2.961 . . . . 19.85 107.11 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 96.8 t -120.96 139.64 47.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 O-C-N 126.508 2.38 . . . . 22.52 110.246 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 32' ' ' MET . . . . . 0.425 ' CG ' ' CD1' ' H' ' 40' ' ' LEU . 47.2 ttm -103.35 118.79 37.57 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 113.87 -2.967 . . . . 24.5 105.995 -177.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . 0.399 0.0 OUTLIER -84.7 119.93 25.82 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 104.241 -2.503 . . . . 34.4 104.241 173.436 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 34' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -125.38 130.78 52.59 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.02 -0.536 . . . . 31.62 111.461 -171.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 35' ' ' ARG . . . . . 0.55 ' N ' ' O ' ' H' ' 39' ' ' GLU . 29.1 ttt180 -78.64 128.78 33.96 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 125.154 2.407 . . . . 41.68 109.201 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 36' ' ' LYS . . . . . . . . . . . . . 10.4 mtpt -63.8 -41.1 97.98 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 115.704 -2.398 . . . . 41.82 115.194 178.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.1 OUTLIER -152.21 108.03 2.81 Favored Pre-proline 0 C--O 1.275 2.436 0 CA-C-O 116.204 -1.855 . . . . 50.0 115.568 -173.291 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 37' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -64.05 135.3 20.42 Favored 'Cis proline' 0 N--CA 1.445 -1.379 0 CA-C-N 121.236 1.477 . . . . 44.65 108.819 -2.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 38' ' ' GLN . . . . . 0.446 ' NE2' ' CG2' ' I' ' 359' ' ' ILE . 5.4 mt-30 -63.51 104.19 0.61 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 112.118 -3.801 . . . . 47.38 106.971 -178.27 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 39' ' ' GLU . . . . . 0.55 ' O ' ' N ' ' H' ' 35' ' ' ARG . 5.7 pt-20 -154.4 150.88 28.36 Favored 'General case' 0 C--N 1.322 -0.625 1 O-C-N 133.189 6.556 . . . . 47.29 116.242 -178.432 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 40' ' ' LEU . . . . . 0.425 ' CD1' ' CG ' ' H' ' 32' ' ' MET . 41.1 tp -67.04 118.76 10.93 Favored 'General case' 0 N--CA 1.433 -1.294 1 CA-C-O 111.002 -4.332 . . . . 35.35 107.713 178.788 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 41' ' ' LEU . . . . . . . . . . . . . 11.9 mt -89.23 -52.46 5.04 Favored 'General case' 0 C--N 1.312 -1.028 1 O-C-N 129.683 4.364 . . . . 35.94 109.1 176.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 42' ' ' CYS . . . . . . . . . . . . . 93.9 m -163.46 -176.8 4.91 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 125.336 1.454 . . . . 24.3 111.662 -173.276 -65.072 -170.382 -101.332 96.315 2.203 99.781 -84.356 -69.737 1 1 . 1 . 001 ecloud orig full ' H' H ' 43' ' ' GLY . . . . . . . . . . . . . . . -96.92 -164.23 32.56 Favored Glycine 0 C--O 1.252 1.242 0 N-CA-C 107.41 -2.276 . . . . 17.59 107.41 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 44' ' ' ALA . . . . . . . . . . . . . . . 169.17 164.93 0.05 OUTLIER 'General case' 0 C--O 1.272 2.253 0 O-C-N 118.764 -2.61 . . . . 16.93 106.102 -174.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 45' ' ' SER . . . . . 0.541 ' OG ' ' OE1' ' H' ' 209' ' ' GLN . 60.3 p -131.05 145.01 51.87 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 117.044 -1.862 . . . . 24.36 108.467 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.45 125.01 35.0 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 113.789 -3.005 . . . . 20.65 103.685 -178.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.266 42.4 pt -119.12 6.42 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 1 O-C-N 130.03 4.581 . . . . 25.88 112.941 -178.318 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -179.01 -174.88 0.36 Allowed 'General case' 0 C--O 1.266 1.961 1 CA-C-O 111.453 -4.118 . . . . 29.07 104.284 176.044 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 49' ' ' ASP . . . . . 0.662 ' N ' ' OD1' ' H' ' 49' ' ' ASP . 21.2 p-10 -82.98 -7.96 59.61 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 124.136 3.153 . . . . 36.28 113.149 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 50' ' ' ARG . . . . . 0.703 ' NH2' ' CD ' ' H' ' 107' ' ' LYS . 7.8 mmm180 -114.98 -11.62 12.12 Favored 'General case' 0 C--O 1.261 1.703 0 N-CA-C 115.221 1.563 . . . . 40.11 115.221 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 51' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -121.4 140.48 52.09 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 125.703 2.668 . . . . 33.38 113.607 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.48 141.85 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 110.912 -2.858 . . . . 22.4 109.332 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 tp -120.6 135.88 54.97 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 121.176 1.807 . . . . 20.64 109.834 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -150.66 175.27 12.1 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.398 -2.183 . . . . 25.33 112.449 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.39 143.47 48.54 Favored 'General case' 0 N--CA 1.52 3.051 1 CA-C-O 111.697 -4.001 . . . . 21.07 110.982 -178.241 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 56' ' ' ALA . . . . . 0.465 ' CB ' ' CG2' ' H' ' 90' ' ' ILE . . . -66.6 -25.04 66.43 Favored 'General case' 0 N--CA 1.492 1.639 1 CA-C-N 126.583 4.265 . . . . 18.77 110.732 172.619 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' OG ' ' H' ' 195' ' ' SER 0.297 5.6 p-80 -67.45 -19.17 65.33 Favored 'General case' 0 C--O 1.274 2.352 1 O-C-N 115.848 -4.283 . . . . 23.53 110.364 -177.307 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 96.7 m -59.94 -25.63 65.33 Favored 'General case' 0 C--O 1.289 3.18 0 CA-C-N 124.836 3.471 . . . . 25.26 114.113 172.289 -69.737 -84.356 -101.332 99.781 2.203 96.315 -170.382 -65.072 1 1 . 1 . 001 ecloud orig full ' H' H ' 59' ' ' LEU . . . . . . . . . . . . . 9.3 mt -104.15 -39.4 6.54 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.437 -2.04 . . . . 26.66 113.84 -175.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -137.6 125.85 23.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.718 3.207 . . . . 28.86 114.491 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' A TYR . . . . . 0.486 ' C ' ' CD ' ' H' ' 60' C PRO . 15.3 t80 -161.19 77.26 2.38 Favored Pre-proline 0 N--CA 1.48 1.056 0 N-CA-C 102.332 -3.21 . . . . 37.73 102.332 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' B PRO . . . . . 0.801 ' N ' ' CD ' ' H' ' 60' C PRO . 3.0 Cg_exo -53.51 -32.43 63.35 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.977 1.785 . . . . 32.16 114.017 -169.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' C PRO . . . . . 0.801 ' CD ' ' N ' ' H' ' 60' B PRO . 6.2 Cg_exo -64.17 -25.96 65.13 Favored 'Trans proline' 0 N--CA 1.425 -2.541 1 C-N-CA 126.214 4.609 . . . . 35.31 116.2 -178.704 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 60' D TRP . . . . . 0.406 ' CZ2' ' C13' ' J' ' 3' ' ' PRJ . 29.9 m0 -112.31 21.44 15.76 Favored 'General case' 0 C--N 1.307 -1.253 2 N-CA-C 95.719 -5.659 . . . . 41.97 95.719 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 60' E ASP . . . . . . . . . . . . 0.289 10.7 m-20 61.96 13.03 5.28 Favored 'General case' 0 N--CA 1.504 2.239 1 N-CA-C 122.089 4.107 . . . . 41.33 122.089 178.733 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 60' F LYS . . . . . 0.47 ' O ' ' N ' ' H' ' 60' A TYR . 4.1 ttpt -90.34 123.66 34.27 Favored 'General case' 0 C--O 1.253 1.26 0 CA-C-O 128.027 3.775 . . . . 32.69 114.265 178.631 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' G ASN . . . . . 0.465 ' ND2' ' O ' ' H' ' 550' ' ' HOH . 62.9 t30 -150.45 70.72 1.03 Allowed 'General case' 0 C--O 1.253 1.277 0 CA-C-N 109.484 -3.507 . . . . 43.6 113.285 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 60' H PHE . . . . . . . . . . . . . 31.4 m-85 -69.24 129.72 40.62 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 126.497 3.046 . . . . 36.4 113.099 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 60' I THR . . . . . . . . . . . . . 0.6 OUTLIER -94.68 166.27 12.09 Favored 'General case' 0 C--N 1.291 -1.946 0 C-N-CA 131.002 3.721 . . . . 43.48 107.585 174.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 61' ' ' GLU . . . . . 0.463 ' OE1' ' CA ' ' H' ' 87' ' ' LYS . 0.0 OUTLIER -57.46 -48.11 80.04 Favored 'General case' 0 C--O 1.259 1.603 0 CA-C-N 112.686 -2.052 . . . . 50.0 116.157 -178.686 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.38 29.96 1.2 Allowed 'General case' 0 C--O 1.217 -0.643 0 O-C-N 118.099 -2.876 . . . . 50.0 111.248 178.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.31 -23.96 15.42 Favored 'General case' 0 C--N 1.284 -2.246 0 O-C-N 127.113 2.758 . . . . 44.56 109.304 178.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 64' ' ' LEU . . . . . 0.438 ' O ' ' O ' ' H' ' 460' ' ' HOH 0.33 9.2 mt -120.66 160.29 23.57 Favored 'General case' 0 C--O 1.262 1.713 2 O-C-N 132.506 6.129 . . . . 36.27 123.067 -174.583 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 65' ' ' LEU . . . . . 0.476 ' CD1' ' CE ' ' H' ' 84' ' ' MET . 0.0 OUTLIER -128.61 157.31 41.63 Favored 'General case' 0 C--N 1.318 -0.778 1 CA-C-O 110.52 -4.562 . . . . 28.98 106.897 169.904 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -113.07 139.3 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-O 113.251 -3.262 . . . . 26.74 102.462 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 67' ' ' ARG . . . . . 0.502 ' CD ' ' CD ' ' H' ' 70' ' ' LYS . 51.2 mtt180 -113.78 121.36 43.82 Favored 'General case' 0 C--O 1.283 2.837 0 CA-C-O 113.316 -3.231 . . . . 37.22 110.45 174.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.93 142.4 34.15 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.118 0 CA-C-N 122.629 2.468 . . . . 26.98 113.356 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 69' ' ' GLY . . . . . 0.736 ' O ' ' CD1' ' H' ' 79' ' ' ILE . . . 101.09 6.99 50.95 Favored Glycine 0 C--O 1.258 1.641 1 O-C-N 115.351 -4.593 . . . . 25.84 108.374 178.11 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 70' ' ' LYS . . . . . 0.502 ' CD ' ' CD ' ' H' ' 67' ' ' ARG . 2.2 mtpp -78.73 156.68 28.78 Favored 'General case' 0 C--N 1.353 0.739 0 O-C-N 129.299 3.588 . . . . 24.39 108.171 -176.37 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 71' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -136.76 -50.62 0.66 Allowed 'General case' 0 N--CA 1.483 1.2 1 CA-C-O 129.531 4.491 . . . . 24.17 102.514 175.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 72' ' ' SER . . . . . 0.414 ' O ' ' CE ' ' H' ' 70' ' ' LYS . 5.0 t -73.06 137.83 45.55 Favored 'General case' 0 N--CA 1.486 1.349 1 O-C-N 115.799 -4.313 . . . . 28.12 107.487 177.951 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 73' ' ' ARG . . . . . 0.63 ' NE ' ' O ' ' H' ' 152' ' ' PRO . 55.6 ttp85 -63.04 -52.21 63.75 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 128.947 3.904 . . . . 35.3 113.949 176.154 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 74' ' ' THR . . . . . 0.691 ' O ' ' O ' ' H' ' 615' ' ' HOH . 20.5 p -109.96 -19.3 13.14 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 119.953 3.316 . . . . 30.72 119.953 -176.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ARG . . . . . 0.582 ' CD ' ' OE1' ' I' ' 357' ' ' GLU . 11.7 mmt180 -72.96 151.07 42.0 Favored 'General case' 0 CA--C 1.493 -1.248 0 O-C-N 118.209 -2.807 . . . . 45.43 115.68 178.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -90.37 110.27 21.36 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 115.647 -2.12 . . . . 41.19 106.39 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' GLU . . . . . 0.464 ' OE1' ' NZ ' ' H' ' 70' ' ' LYS . 27.5 mt-10 -85.17 81.05 9.0 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-O 127.568 3.556 . . . . 31.98 109.673 -174.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 77' A ARG . . . . . 0.421 ' O ' ' CG ' ' H' ' 77' A ARG . 9.8 ttp85 -32.91 -47.24 0.17 Allowed 'General case' 0 C--O 1.288 3.106 2 CA-C-O 106.823 -6.323 . . . . 38.36 115.866 -173.18 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' ASN . . . . . 0.972 ' N ' ' O ' ' H' ' 453' ' ' HOH . 28.3 m120 -127.32 23.18 6.44 Favored 'General case' 0 N--CA 1.493 1.715 1 CA-C-N 127.396 4.634 . . . . 33.42 110.916 175.635 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' ILE . . . . . 0.736 ' CD1' ' O ' ' H' ' 69' ' ' GLY 0.45 0.5 OUTLIER -109.95 -53.14 5.95 Favored 'Isoleucine or valine' 0 C--O 1.26 1.628 0 CA-C-O 114.079 -2.867 . . . . 36.07 109.666 179.5 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' GLU . . . . . 0.494 ' OE1' ' NZ ' ' H' ' 70' ' ' LYS . 8.6 pt-20 -89.14 153.99 20.51 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 113.528 -3.13 . . . . 30.79 113.402 -175.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -127.19 134.45 50.14 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 121.04 1.746 . . . . 46.46 107.323 177.691 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 mt -103.95 134.86 44.05 Favored 'Isoleucine or valine' 0 C--O 1.269 2.124 0 CA-C-O 112.553 -3.594 . . . . 33.11 110.502 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -135.07 156.04 49.71 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 122.044 2.202 . . . . 33.69 110.051 179.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' MET . . . . . 0.476 ' CE ' ' CD1' ' H' ' 65' ' ' LEU . 0.1 OUTLIER -96.94 156.27 16.42 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 128.625 3.703 . . . . 50.0 101.22 -178.35 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' LEU . . . . . 0.401 ' CD1' ' CE ' ' H' ' 106' ' ' MET . 0.3 OUTLIER -105.6 149.02 26.67 Favored 'General case' 0 C--N 1.317 -0.84 1 O-C-N 129.663 4.352 . . . . 35.52 107.157 178.817 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' GLU . . . . . 0.51 ' OE2' ' NH2' ' H' ' 50' ' ' ARG . 5.8 tt0 -99.09 -40.03 8.21 Favored 'General case' 0 C--N 1.309 -1.187 1 CA-C-N 105.723 -5.217 . . . . 49.34 107.862 179.609 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' LYS . . . . . 0.463 ' CA ' ' OE1' ' H' ' 61' ' ' GLU . 0.1 OUTLIER -154.25 156.28 36.75 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 120.638 1.563 . . . . 41.1 109.924 -178.38 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' ILE . . . . . 0.423 ' N ' ' OE1' ' H' ' 61' ' ' GLU . 14.6 mt -129.25 130.39 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 O-C-N 128.391 3.557 . . . . 35.99 102.517 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' TYR . . . . . 0.726 ' CE2' ' CE1' ' H' ' 245' ' ' PHE . 82.0 m-85 -133.55 117.78 17.51 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 112.123 -3.798 . . . . 38.96 106.083 -177.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' ILE . . . . . 0.465 ' CG2' ' CB ' ' H' ' 56' ' ' ALA . 2.4 mm -100.66 151.28 5.28 Favored 'Isoleucine or valine' 0 C--O 1.25 1.1 1 O-C-N 129.467 4.229 . . . . 30.91 105.868 178.721 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -60.66 127.52 87.16 Favored Pre-proline 0 N--CA 1.487 1.391 0 O-C-N 127.83 3.206 . . . . 27.63 106.086 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -58.38 -18.81 40.25 Favored 'Trans proline' 0 C--O 1.269 2.058 0 C-N-CA 121.142 1.228 . . . . 29.74 111.994 -177.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -115.42 21.08 14.36 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 115.839 -2.029 . . . . 37.09 114.128 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -57.77 121.79 11.29 Favored 'General case' 0 C--O 1.266 1.953 0 O-C-N 125.746 1.904 . . . . 24.57 109.814 171.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -87.12 84.43 7.28 Favored 'General case' 0 C--O 1.275 2.431 0 O-C-N 119.463 -2.023 . . . . 24.7 115.078 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -76.45 -18.61 58.7 Favored 'General case' 0 N--CA 1.504 2.255 1 C-N-CA 111.562 -4.055 . . . . 30.9 111.793 176.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -70.81 -40.82 72.28 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 126.814 2.046 . . . . 47.61 115.718 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' A GLU . . . . . 0.425 ' OE1' ' NH2' ' H' ' 175' ' ' ARG . 15.3 tt0 -116.28 -71.84 0.72 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 118.286 -1.365 . . . . 45.36 111.068 -179.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' ASN . . . . . 0.756 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 41.5 p-10 -119.96 20.4 12.17 Favored 'General case' 0 C--N 1.406 3.055 0 CA-C-O 113.345 -3.217 . . . . 23.73 119.012 -173.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' LEU . . . . . . . . . . . . . 4.9 mt 62.05 27.08 16.36 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 124.464 3.302 . . . . 27.27 112.093 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' ASP . . . . . 0.527 ' OD1' ' OG1' ' H' ' 177' ' ' THR . 16.7 t0 -58.76 131.12 49.95 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 104.454 -2.424 . . . . 24.12 104.454 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 65.61 40.36 4.53 Favored 'General case' 0 C--O 1.267 2.018 0 O-C-N 126.39 2.306 . . . . 35.52 115.134 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' ASP . . . . . 0.573 ' OD2' ' OG ' ' H' ' 214' ' ' SER . 44.3 t0 -77.08 83.36 3.58 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 113.366 -1.743 . . . . 17.7 107.622 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ILE . . . . . 0.478 ' CG2' ' CD1' ' H' ' 234' ' ' LEU . 2.3 tt -158.26 137.7 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 129.437 3.095 . . . . 19.65 109.766 -173.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.13 150.65 20.43 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 102.741 -3.059 . . . . 20.0 102.741 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 10.1 mt -120.01 133.64 55.48 Favored 'General case' 0 C--O 1.253 1.274 0 C-N-CA 128.58 2.752 . . . . 24.95 109.491 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' MET . . . . . 0.401 ' CE ' ' CD1' ' H' ' 85' ' ' LEU . 39.8 mtp -117.49 116.8 27.86 Favored 'General case' 0 C--O 1.27 2.154 1 O-C-N 132.018 5.824 . . . . 32.35 107.378 175.545 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' LYS . . . . . 0.703 ' CD ' ' NH2' ' H' ' 50' ' ' ARG . 0.0 OUTLIER -100.42 125.06 46.66 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 104.05 -2.574 . . . . 50.0 104.05 178.574 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 19.3 mt -71.25 145.55 49.53 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 127.06 2.725 . . . . 34.31 112.241 -168.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . 0.401 ' N ' ' O ' ' H' ' 84' ' ' MET . 0.0 OUTLIER -62.13 -20.81 64.47 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 122.655 1.217 . . . . 50.0 113.219 -179.151 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' LYS . . . . . 0.459 ' CG ' ' CD ' ' H' ' 111' ' ' PRO . 9.9 tptm -156.91 149.49 18.07 Favored Pre-proline 0 N--CA 1.468 0.455 0 C-N-CA 124.688 1.195 . . . . 49.93 109.063 177.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . 0.459 ' CD ' ' CG ' ' H' ' 110' ' ' LYS . 2.4 Cg_endo -65.51 154.81 72.03 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 O-C-N 125.083 2.096 . . . . 36.67 107.106 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' VAL . . . . . 0.62 ' CG2' ' O ' ' H' ' 49' ' ' ASP . 0.2 OUTLIER -103.4 159.78 4.68 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 C-N-CA 126.688 1.995 . . . . 35.22 106.902 179.631 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -107.92 139.77 42.05 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 110.391 -3.095 . . . . 31.13 103.355 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' PHE . . . . . 0.423 ' CZ ' ' CB ' ' H' ' 49' ' ' ASP . 11.4 m-30 -82.75 167.46 18.14 Favored 'General case' 0 C--O 1.265 1.878 1 O-C-N 131.047 5.217 . . . . 28.61 107.153 -174.191 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' H' ' 116' ' ' ASP . 0.6 OUTLIER -167.52 -168.11 0.98 Allowed 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 101.65 -3.463 . . . . 26.89 101.65 -172.074 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . 0.597 ' N ' ' OG ' ' H' ' 115' ' ' SER . 84.5 m-20 -77.73 -11.39 59.87 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 126.972 2.67 . . . . 35.01 111.064 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -107.68 -20.25 13.28 Favored 'General case' 0 C--O 1.252 1.206 1 O-C-N 131.518 5.511 . . . . 26.4 113.898 -175.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' ILE . . . . . . . . . . . . . 9.7 mt -123.68 107.45 18.91 Favored 'Isoleucine or valine' 0 C--O 1.256 1.409 1 C-N-CA 133.596 4.758 . . . . 22.07 115.102 -176.309 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' HIS . . . . . 0.608 ' CD2' ' O ' ' L' ' 3' ' ' LEU . 51.9 t60 -148.21 135.94 10.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 112.243 -2.253 . . . . 27.27 109.949 -175.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -74.55 156.24 45.05 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 CA-C-N 124.03 2.475 . . . . 21.13 116.321 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' VAL . . . . . . . . . . . . . 3.4 p -96.15 158.72 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 118.211 -2.805 . . . . 17.99 106.535 177.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' CYS . . . . . . . . . . . . . 91.0 m -90.87 147.5 23.12 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 113.077 -3.344 . . . . 17.81 110.644 -179.775 -68.329 -52.627 96.047 104.621 2.006 102.158 79.693 67.354 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' LEU . . . . . 0.797 ' O ' ' CA ' ' L' ' 1' E SER . 93.6 mt -93.47 140.64 23.23 Favored Pre-proline 0 C--N 1.298 -1.669 0 N-CA-C 104.37 -2.456 . . . . 21.93 104.37 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' PRO . . . . . 0.839 ' O ' ' NZ ' ' H' ' 235' ' ' LYS . 1.4 Cg_endo -72.2 153.2 56.7 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 123.167 2.578 . . . . 25.1 114.218 -174.459 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' ASP . . . . . 0.601 ' O ' ' N ' ' H' ' 127' ' ' GLU . 3.5 p30 -103.8 149.26 25.2 Favored 'General case' 0 C--O 1.273 2.296 0 O-C-N 126.272 2.232 . . . . 37.88 110.161 172.361 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . 0.597 ' C ' ' O ' ' H' ' 125' ' ' ASP . 48.7 ttt-85 -34.81 -33.96 0.03 OUTLIER 'General case' 0 C--O 1.251 1.153 1 O-C-N 116.078 -4.139 . . . . 50.0 112.716 -178.339 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' H' ' 125' ' ' ASP . 0.2 OUTLIER -84.07 -36.12 23.27 Favored 'General case' 0 C--O 1.266 1.951 0 CA-C-N 122.99 2.632 . . . . 44.66 114.38 -174.158 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 92.0 m -66.4 -45.5 79.75 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 112.008 -2.36 . . . . 32.36 109.548 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.4 -46.8 83.08 Favored 'General case' 0 C--N 1.288 -2.078 2 C-N-CA 132.933 4.493 . . . . 31.08 107.349 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.18 -42.82 79.41 Favored 'General case' 0 C--O 1.257 1.483 0 O-C-N 117.105 -3.497 . . . . 32.86 110.551 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' B SER . . . . . . . . . . . . . 4.1 p -87.9 -5.86 58.36 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 125.306 3.684 . . . . 40.34 116.09 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' C LEU . . . . . . . . . . . . . 17.1 mt -107.34 -40.28 5.43 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.121 -1.418 . . . . 27.99 111.143 -174.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.31 73.39 0.97 Allowed 'General case' 0 N--CA 1.498 1.971 1 O-C-N 130.667 4.979 . . . . 30.23 110.889 -176.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -135.22 139.28 44.37 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 125.886 2.755 . . . . 47.81 108.889 -176.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.34 138.67 58.25 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 113.61 -3.091 . . . . 30.2 103.164 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.15 -36.45 4.32 Favored Glycine 0 N--CA 1.48 1.581 1 O-C-N 135.239 7.837 . . . . 28.39 109.897 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -63.86 140.89 58.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 129.868 3.923 . . . . 32.92 108.905 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 135' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -100.29 142.18 32.12 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.494 1.517 . . . . 28.28 114.353 174.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 136' ' ' GLY . . . . . . . . . . . . . . . -121.43 -178.81 15.92 Favored Glycine 0 CA--C 1.553 2.421 1 C-N-CA 134.039 5.59 . . . . 18.99 105.163 -179.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -137.8 137.54 38.3 Favored 'General case' 0 N--CA 1.441 -0.884 1 CA-C-O 106.371 -6.538 . . . . 22.72 104.739 -172.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 1.4 t -122.12 154.82 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 1 O-C-N 134.585 7.428 . . . . 18.91 102.32 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 139' ' ' THR . . . . . 0.608 ' OG1' ' OE1' ' H' ' 30' ' ' GLN . 22.7 p -148.67 154.39 39.6 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 111.175 -2.739 . . . . 25.07 111.012 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 167.19 164.14 22.32 Favored Glycine 0 C--N 1.282 -2.438 2 O-C-N 131.043 5.214 . . . . 19.25 110.772 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 141' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -101.98 12.43 36.91 Favored 'General case' 0 C--O 1.251 1.183 0 O-C-N 129.404 3.649 . . . . 28.55 110.781 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -68.4 -170.2 5.77 Favored Glycine 0 CA--C 1.54 1.656 2 O-C-N 109.301 -8.375 . . . . 27.84 111.523 -177.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -53.32 143.36 18.95 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-O 107.96 -5.781 . . . . 38.66 110.269 -176.116 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.15 -17.53 27.46 Favored 'General case' 0 C--N 1.307 -1.26 2 O-C-N 133.618 6.823 . . . . 32.26 109.636 177.024 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.322 0.2 OUTLIER -157.08 158.29 36.16 Favored 'General case' 0 N--CA 1.506 2.373 1 O-C-N 130.675 4.984 . . . . 50.0 106.547 177.422 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 146' ' ' GLU . . . . . 0.518 ' O ' ' CG ' ' H' ' 146' ' ' GLU . 77.2 tt0 -54.54 -32.15 57.73 Favored 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.254 3.471 . . . . 41.72 119.563 -171.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 147' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.294 3.409 1 C-N-CA 132.351 4.26 . . . . 46.31 101.908 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 109.462 -1.455 . . . . 39.25 109.462 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 151' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -98.26 151.57 37.57 Favored Pre-proline 0 N--CA 1.479 1.018 0 N-CA-C 107.205 -1.406 . . . . 49.79 107.205 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 152' ' ' PRO . . . . . 0.63 ' O ' ' NE ' ' H' ' 73' ' ' ARG . 6.5 Cg_endo -87.19 161.5 8.52 Favored 'Trans proline' 0 C--N 1.293 -2.381 0 C-N-CA 123.394 2.729 . . . . 34.98 105.225 -169.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 11.2 p -91.41 -27.93 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 126.539 2.4 . . . . 27.21 107.008 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 154' ' ' VAL . . . . . 0.573 ' CG1' ' CB ' ' H' ' 21' ' ' ASP 0.299 1.2 t -118.0 157.27 19.42 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.954 0 CA-C-O 124.584 2.135 . . . . 25.79 112.8 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 39.7 tp -51.53 137.49 24.25 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-O 115.915 -1.993 . . . . 23.01 110.72 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 156' ' ' GLN . . . . . 0.663 ' C ' ' CG1' ' H' ' 157' ' ' VAL . 21.5 mm100 -113.09 163.04 15.22 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 124.27 3.214 . . . . 18.96 107.358 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 157' ' ' VAL . . . . . 0.663 ' CG1' ' C ' ' H' ' 156' ' ' GLN 0.269 6.1 m -145.53 147.13 18.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 2 O-C-N 129.611 4.32 . . . . 27.47 111.209 -179.965 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.25 149.47 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 1 O-C-N 130.328 4.767 . . . . 19.83 105.325 175.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 159' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -107.52 134.57 50.35 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 111.81 -3.948 . . . . 25.13 103.471 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 160' ' ' LEU . . . . . . . . . . . . . 19.9 mt -129.88 151.91 79.01 Favored Pre-proline 0 C--N 1.275 -2.66 0 CA-C-O 126.482 3.039 . . . . 24.63 112.969 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -84.38 148.15 11.45 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 115.428 -2.985 . . . . 25.58 108.652 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.07 138.29 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.637 0 N-CA-C 101.584 -3.487 . . . . 27.59 101.584 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 85.2 t -114.35 145.5 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-O 124.657 2.17 . . . . 24.97 105.557 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -61.89 134.68 56.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 110.949 -2.841 . . . . 49.9 109.264 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 165' ' ' ARG . . . . . 0.631 ' NH2' ' O ' ' H' ' 177' ' ' THR . 0.1 OUTLIER -46.75 -57.17 9.48 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 126.303 1.841 . . . . 50.0 112.463 -173.974 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 166' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' H' ' 165' ' ' ARG . 4.6 Cg_exo -51.93 -43.89 49.01 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 124.677 3.585 . . . . 29.25 108.925 -178.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 50.7 t -59.17 -40.78 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 127.71 3.624 . . . . 28.37 107.649 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . 0.317 75.6 m -54.36 -65.79 0.51 Allowed 'General case' 0 C--O 1.252 1.228 0 O-C-N 118.651 -2.531 . . . . 27.72 109.46 -176.863 -63.54 -66.179 -81.336 107.71 1.992 105.156 -85.551 91.115 2 2 . 1 . 001 ecloud orig full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . 0.355 3.6 mmtp -43.15 -53.55 4.93 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 126.865 2.066 . . . . 47.83 115.361 175.703 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.15 -8.0 1.39 Allowed 'General case' 0 C--N 1.31 -1.123 1 C-N-CA 133.318 4.647 . . . . 23.06 114.374 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 19.7 p -108.68 -6.9 15.76 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 127.645 3.09 . . . . 24.21 111.588 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.313 2.1 t -145.98 178.18 8.39 Favored 'General case' 1 C--O 1.306 4.056 0 N-CA-C 106.266 -1.754 . . . . 22.0 106.266 -179.834 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 173' ' ' ARG . . . . . . . . . . . . 0.264 8.5 mtp180 -114.59 -3.1 12.96 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 111.459 -2.61 . . . . 45.78 109.646 177.98 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 8.2 mm -79.62 140.69 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 1 O-C-N 129.561 4.288 . . . . 22.43 107.115 176.582 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 175' ' ' ARG . . . . . 0.756 ' O ' ' ND2' ' H' ' 98' ' ' ASN . 35.2 ttp85 -82.54 118.36 23.21 Favored 'General case' 0 N--CA 1.512 2.67 0 CA-C-O 128.455 3.978 . . . . 29.95 110.076 176.38 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 176' ' ' ILE . . . . . . . . . . . . 0.296 1.1 mm -81.43 128.39 38.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 2 C-N-CA 136.267 5.827 . . . . 25.93 107.681 -178.897 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 177' ' ' THR . . . . . 0.631 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.3 p -111.89 163.35 14.31 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.094 -3.504 . . . . 29.73 108.712 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.58 -25.06 6.15 Favored 'General case' 0 C--N 1.306 -1.297 1 C-N-CA 133.451 4.7 . . . . 30.76 113.187 175.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -74.43 10.98 1.09 Allowed 'General case' 0 C--O 1.28 2.677 1 CA-C-O 111.635 -4.031 . . . . 23.4 112.063 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 17.7 mtt -132.79 156.86 46.33 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 126.348 2.28 . . . . 18.04 108.957 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -144.19 158.65 43.61 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 102.057 -3.312 . . . . 16.45 102.057 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 182' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -124.74 150.98 45.66 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 103.245 -2.872 . . . . 22.42 103.245 -177.839 91.115 -85.551 -81.336 105.156 1.992 107.71 -66.179 -63.54 2 2 . 1 . 001 ecloud orig full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -149.49 147.51 28.3 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 109.996 -3.274 . . . . 24.37 109.744 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 184' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' H' ' 464' ' ' HOH . . . 152.54 171.16 19.79 Favored Glycine 0 N--CA 1.433 -1.565 1 C-N-CA 131.619 4.438 . . . . 19.5 114.227 179.316 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 184' A TYR . . . . . 0.707 ' O ' ' O ' ' H' ' 503' ' ' HOH . 96.3 m-85 -85.45 153.65 22.35 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.058 -1.26 . . . . 29.73 111.88 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 185' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' H' ' 186' B GLU . 4.8 mmtp -87.71 144.62 35.47 Favored Pre-proline 0 C--N 1.306 -1.304 0 O-C-N 117.352 -3.342 . . . . 40.46 106.454 175.072 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -63.67 -20.85 69.75 Favored 'Trans proline' 0 N--CA 1.484 0.954 0 N-CA-C 105.363 -2.591 . . . . 42.54 105.363 -170.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 186' A ASP . . . . . . . . . . . . 0.28 0.2 OUTLIER -68.12 -42.1 80.74 Favored 'General case' 0 N--CA 1.484 1.267 2 O-C-N 131.495 5.497 . . . . 50.0 102.725 -179.011 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 186' B GLU . . . . . 0.421 ' N ' ' O ' ' H' ' 185' ' ' LYS . 66.0 mt-10 -62.47 -34.82 77.57 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 127.496 2.998 . . . . 49.13 116.576 -175.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 85.89 31.64 20.15 Favored Glycine 0 C--N 1.28 -2.583 1 O-C-N 114.133 -5.354 . . . . 42.33 110.208 161.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.62 142.1 29.89 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 126.985 2.227 . . . . 43.09 105.384 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 187' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.26 -162.43 1.26 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 117.772 -3.08 . . . . 31.57 113.464 179.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 188' ' ' GLY . . . . . 0.55 ' CA ' ' O ' ' H' ' 17' ' ' VAL . . . 125.13 152.41 8.26 Favored Glycine 1 C--N 1.404 4.336 4 C-N-CA 111.783 -5.008 . . . . 20.36 100.59 -177.788 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' H' H ' 189' ' ' ASP . . . . . 0.488 ' OD1' ' NH1' ' J' ' 4' ' ' OAR . 50.0 t0 -178.05 160.11 1.39 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 102.904 -2.999 . . . . 27.58 102.904 -177.458 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.21 -173.33 1.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 103.056 -2.942 . . . . 23.58 103.056 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 191' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' H' ' 192' ' ' GLU . 10.5 t -167.94 170.67 10.4 Favored 'General case' 0 N--CA 1.483 1.221 1 N-CA-C 99.237 -4.357 . . . . 28.77 99.237 177.282 -164.27 42.833 84.784 100.104 2.013 99.268 178.438 -38.835 3 3 . 1 . 001 ecloud orig full ' H' H ' 192' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' H' ' 191' ' ' CYS 0.513 0.0 OUTLIER -37.9 154.53 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 104.455 -2.424 . . . . 45.51 104.455 171.972 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 80.44 -25.15 3.36 Favored Glycine 0 C--O 1.262 1.865 0 C-N-CA 130.23 3.776 . . . . 24.56 112.735 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 194' ' ' ASP . . . . . 0.425 ' OD2' ' N ' ' H' ' 16' ' ' ILE . 41.5 m-20 -76.05 -31.99 59.09 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 129.714 3.206 . . . . 29.35 112.223 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 195' ' ' SER . . . . . 0.849 ' CB ' ' C ' ' J' ' 4' ' ' OAR . 0.1 OUTLIER -41.02 147.35 0.13 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.568 -1.957 . . . . 28.11 114.651 -178.162 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.3 -7.96 80.9 Favored Glycine 0 C--O 1.251 1.214 0 CA-C-O 125.898 2.943 . . . . 18.77 110.011 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -77.09 176.41 53.28 Favored Glycine 0 C--N 1.348 1.243 1 O-C-N 114.611 -5.053 . . . . 20.77 105.536 -173.253 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . 0.279 2.1 Cg_endo -93.77 145.34 2.02 Favored 'Trans proline' 0 C--O 1.267 1.953 0 CA-C-N 113.411 -1.394 . . . . 19.65 113.376 176.457 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 199' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -111.19 123.1 49.52 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 100.436 -3.913 . . . . 14.42 100.436 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.34 153.43 19.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 2 O-C-N 112.709 -6.245 . . . . 20.59 110.326 -170.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' MET . . . . . 1.003 ' CE ' ' CG ' ' H' ' 210' ' ' MET . 37.0 mtm -129.47 154.07 47.34 Favored 'General case' 0 C--O 1.268 2.071 0 CA-C-N 108.964 -3.743 . . . . 20.72 105.796 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -101.06 119.9 39.42 Favored 'General case' 0 N--CA 1.491 1.577 1 O-C-N 129.679 4.362 . . . . 24.48 109.201 177.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' SER . . . . . . . . . . . . . 30.9 t -67.19 131.7 93.53 Favored Pre-proline 0 C--O 1.274 2.364 0 O-C-N 125.996 2.06 . . . . 17.74 113.022 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -79.39 -6.85 14.83 Favored 'Trans proline' 0 C--O 1.267 1.934 0 CA-C-N 111.72 -1.921 . . . . 20.08 110.68 175.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' A PHE . . . . . . . . . . . . . 34.1 m-85 -86.77 -49.61 7.33 Favored 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 123.518 0.727 . . . . 25.62 111.293 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 204' B ASN . . . . . 0.667 ' ND2' ' C ' ' H' ' 204' B ASN . 0.1 OUTLIER -121.09 14.93 11.49 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-N 112.441 -2.163 . . . . 23.38 116.011 179.736 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 57.37 8.51 0.61 Allowed 'General case' 0 C--O 1.255 1.39 0 N-CA-C 117.947 2.573 . . . . 34.84 117.947 175.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' ARG . . . . . 0.405 ' NH2' ' O ' ' H' ' 598' ' ' HOH . 24.1 mtt-85 -83.35 153.32 24.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 128.147 2.579 . . . . 30.49 115.492 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -95.53 124.71 39.69 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 116.408 -1.758 . . . . 19.15 112.986 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -113.94 142.96 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 119.776 1.171 . . . . 24.72 112.118 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' GLN . . . . . 0.541 ' OE1' ' OG ' ' H' ' 45' ' ' SER . 61.0 tt0 -94.16 109.95 21.71 Favored 'General case' 0 C--O 1.273 2.337 0 CA-C-N 124.061 3.118 . . . . 17.57 107.604 172.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' MET . . . . . 1.003 ' CG ' ' CE ' ' H' ' 201' ' ' MET . 6.6 mmt -81.98 -38.92 24.39 Favored 'General case' 0 C--O 1.28 2.703 0 CA-C-O 124.88 2.276 . . . . 28.19 116.077 173.664 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -130.87 153.69 20.41 Favored Glycine 0 N--CA 1.497 2.75 0 O-C-N 117.87 -3.019 . . . . 18.53 118.811 -174.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' ILE . . . . . . . . . . . . . 43.4 mt -112.73 129.24 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.317 0 O-C-N 118.79 -2.594 . . . . 19.83 107.568 171.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 20.5 t -57.89 110.24 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.391 1 O-C-N 114.919 -4.863 . . . . 21.52 107.99 -177.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' SER . . . . . 0.573 ' OG ' ' OD2' ' H' ' 102' ' ' ASP . 0.8 OUTLIER -109.63 -69.67 0.85 Allowed 'General case' 0 C--O 1.272 2.245 0 N-CA-C 116.224 1.935 . . . . 19.11 116.224 -173.689 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 215' ' ' TRP . . . . . . . . . . . . . 37.3 p-90 -156.53 165.92 34.89 Favored 'General case' 0 CA--C 1.478 -1.808 0 C-N-CA 115.344 -2.542 . . . . 25.12 106.797 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 216' ' ' GLY . . . . . 0.602 ' O ' ' N ' ' J' ' 2' ' ' LEU . . . -164.93 151.64 20.73 Favored Glycine 0 CA--C 1.547 2.072 0 CA-C-O 114.552 -3.36 . . . . 20.96 104.964 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 217' ' ' GLU . . . . . 0.584 ' O ' ' O ' ' H' ' 219' ' ' GLY . 0.2 OUTLIER -75.46 100.39 4.48 Favored 'General case' 1 C--N 1.493 6.847 0 O-C-N 128.77 3.277 . . . . 33.27 110.46 169.638 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' H' H ' 219' ' ' GLY . . . . . 0.806 ' N ' ' O4 ' ' J' ' 1' ' ' 34H . . . 54.56 154.25 0.01 OUTLIER Glycine 0 C--N 1.27 -3.096 0 N-CA-C 109.864 -1.294 . . . . 28.53 109.864 -175.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -84.21 132.15 34.68 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 127.156 3.36 . . . . 30.29 114.823 176.474 -38.835 178.438 84.784 99.268 2.013 100.104 42.833 -164.27 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' ' ' ASP . . . . . . . . . . . . . 23.2 t0 50.94 38.17 19.49 Favored 'General case' 0 C--O 1.272 2.284 0 O-C-N 116.449 -3.907 . . . . 33.39 112.815 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 221' A ARG . . . . . . . . . . . . . 4.6 mmt85 -82.41 136.27 34.99 Favored 'General case' 0 C--O 1.264 1.832 0 O-C-N 117.059 -3.526 . . . . 41.02 106.103 173.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.77 131.98 30.95 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 118.179 -2.826 . . . . 49.44 111.388 172.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 76.98 4.11 82.39 Favored Glycine 0 C--O 1.248 1.003 0 O-C-N 120.226 -1.546 . . . . 34.41 115.315 176.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 224' ' ' LYS . . . . . . . . . . . . . 17.0 mttp -114.1 156.27 24.48 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 107.306 -1.368 . . . . 35.37 107.306 174.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -132.25 150.41 52.16 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 126.927 2.091 . . . . 31.16 113.885 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 226' ' ' GLY . . . . . . . . . . . . . . . -76.91 150.61 37.89 Favored Glycine 0 CA--C 1.489 -1.54 0 N-CA-C 104.076 -3.61 . . . . 22.73 104.076 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -115.82 142.71 46.4 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 108.995 -3.603 . . . . 18.47 110.886 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 228' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -139.29 143.09 37.75 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 112.234 -3.746 . . . . 20.57 113.612 -175.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 229' ' ' THR . . . . . 0.466 ' OG1' ' O ' ' H' ' 102' ' ' ASP . 0.3 OUTLIER -63.11 143.21 57.99 Favored 'General case' 0 C--O 1.265 1.874 0 O-C-N 126.82 2.575 . . . . 16.81 110.19 173.389 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -89.91 90.26 8.09 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.865 1.666 . . . . 27.67 109.264 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 231' ' ' VAL . . . . . . . . . . . . . 4.2 t -54.12 -46.29 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 114.238 -2.791 . . . . 19.32 108.814 -172.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 232' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -59.65 -45.88 90.68 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 116.087 -2.245 . . . . 31.76 113.899 178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -55.9 -21.52 20.84 Favored 'General case' 0 C--O 1.248 1.003 1 O-C-N 114.616 -5.053 . . . . 34.63 107.884 -176.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 234' ' ' LEU . . . . . 0.478 ' CD1' ' CG2' ' H' ' 103' ' ' ILE . 1.5 mt -107.69 3.21 24.42 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 115.714 -2.395 . . . . 26.58 114.49 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 235' ' ' LYS . . . . . 0.839 ' NZ ' ' O ' ' H' ' 124' ' ' PRO . 36.2 tttt -55.59 -39.53 70.86 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-N 117.717 0.235 . . . . 35.19 110.545 -175.26 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -36.03 82.26 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 114.441 -2.904 . . . . 50.0 110.634 -175.13 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 52.2 t90 -67.29 -49.29 64.85 Favored 'General case' 0 CA--C 1.507 -0.694 0 O-C-N 118.295 -2.753 . . . . 31.93 104.424 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 238' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.08 -34.94 54.73 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 O-C-N 127.523 3.014 . . . . 30.77 110.566 179.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 239' ' ' GLN . . . . . 0.506 ' N ' ' O ' ' H' ' 235' ' ' LYS . 0.0 OUTLIER -66.3 -47.15 74.53 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 124.438 1.086 . . . . 50.0 108.465 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 240' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -63.45 1.14 Allowed 'General case' 0 C--O 1.262 1.741 0 CA-C-O 114.614 -2.613 . . . . 50.0 115.177 177.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 241' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -58.9 -33.29 49.32 Favored 'Isoleucine or valine' 0 C--O 1.267 1.99 0 CA-C-N 124.6 3.364 . . . . 41.31 113.473 -176.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 242' ' ' ILE . . . . . 0.613 ' O ' ' CA ' ' H' ' 246' ' ' GLY . 47.2 mt -67.63 -44.79 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 117.285 -1.766 . . . . 43.17 109.19 -178.435 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 -44.97 94.96 Favored 'General case' 0 N--CA 1.491 1.611 1 CA-C-O 130.606 5.003 . . . . 50.0 107.069 179.656 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 244' ' ' GLN . . . . . . . . . . . . 0.259 3.7 mm100 -55.52 -43.88 76.14 Favored 'General case' 0 C--N 1.314 -0.958 1 CA-C-N 105.393 -5.367 . . . . 50.0 112.204 -175.46 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' H' H ' 245' ' ' PHE . . . . . 0.726 ' CE1' ' CE2' ' H' ' 89' ' ' TYR . 0.3 OUTLIER -161.02 31.0 0.14 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 114.808 -2.757 . . . . 50.0 108.388 -179.733 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 246' ' ' GLY . . . . . 0.613 ' CA ' ' O ' ' H' ' 242' ' ' ILE . . . -72.66 -160.09 5.13 Favored Glycine 0 C--O 1.259 1.705 1 N-CA-C 126.405 5.322 . . . . 50.0 126.405 -178.313 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 247' ' ' GLU . . . . . 0.702 ' CG ' ' CG ' ' H' ' 50' ' ' ARG 0.268 2.2 mm-40 . . . . . 0 C--O 1.277 2.518 0 CA-C-N 109.323 -3.439 . . . . 50.0 107.93 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 355' ' ' ASP . . . . . . . . . . . . . 47.0 t0 . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 128.286 3.898 . . . . 50.0 105.321 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 356' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -76.28 115.25 15.83 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 109.454 -3.521 . . . . 43.98 111.393 178.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 357' ' ' GLU . . . . . 0.582 ' OE1' ' CD ' ' H' ' 75' ' ' ARG . 40.4 tt0 -56.04 158.92 3.6 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 125.481 1.738 . . . . 45.78 106.418 174.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 358' ' ' GLU . . . . . 0.505 ' N ' ' CG ' ' I' ' 357' ' ' GLU . 0.0 OUTLIER -72.32 145.36 47.86 Favored 'General case' 0 C--O 1.265 1.888 0 N-CA-C 114.516 1.302 . . . . 50.0 114.516 -172.161 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 359' ' ' ILE . . . . . 0.446 ' CG2' ' NE2' ' H' ' 38' ' ' GLN . 0.1 OUTLIER -107.52 149.97 39.52 Favored Pre-proline 0 C--O 1.242 0.707 0 CA-C-O 111.969 -3.872 . . . . 50.0 107.728 177.521 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 360' ' ' PRO . . . . . 0.597 ' O ' ' N ' ' I' ' 363' ' ' TYS . 9.4 Cg_endo -68.4 126.23 13.94 Favored 'Trans proline' 0 N--CA 1.441 -1.574 2 O-C-N 132.075 5.776 . . . . 50.0 115.877 178.355 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' I' I ' 361' ' ' GLU . . . . . 0.601 ' C ' ' N ' ' I' ' 363' ' ' TYS . . . -52.09 -25.67 9.3 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 110.523 -3.035 . . . . 50.0 110.842 -175.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 362' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.73 -18.39 8.13 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 102.112 -3.292 . . . . 50.0 102.112 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 363' ' ' TYS . . . . . 0.601 ' N ' ' C ' ' I' ' 361' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 364' ' ' LEU . . . . . . . . . . . . . 20.8 mt . . . . . 0 C--O 1.27 2.139 0 CA-C-O 114.94 -2.457 . . . . 50.0 106.646 179.834 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 1' ' ' 34H . . . . . 0.806 ' O4 ' ' N ' ' H' ' 219' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 2' ' ' LEU . . . . . 0.602 ' N ' ' O ' ' H' ' 216' ' ' GLY 0.332 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 N-CA-C 100.99 -3.707 . . . . 35.33 100.99 . . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' J' J ' 3' ' ' PRJ . . . . . 0.406 ' C13' ' CZ2' ' H' ' 60' D TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 4' ' ' OAR . . . . . 0.849 ' C ' ' CB ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 626' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 453' ' ' HOH . . . . . 0.972 ' O ' ' N ' ' H' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 460' ' ' HOH . . . . . 0.438 ' O ' ' O ' ' H' ' 64' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 464' ' ' HOH . . . . . 0.49 ' O ' ' O ' ' H' ' 184' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 500' ' ' HOH . . . . . 0.623 ' O ' ' CD1' ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 503' ' ' HOH . . . . . 0.707 ' O ' ' O ' ' H' ' 184' A TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 529' ' ' HOH . . . . . 0.706 ' O ' ' CA ' ' L' ' 1' D GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 550' ' ' HOH . . . . . 0.465 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 584' ' ' HOH . . . . . 0.414 ' O ' ' NH1' ' H' ' 175' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 598' ' ' HOH . . . . . 0.405 ' O ' ' NH2' ' H' ' 206' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 615' ' ' HOH . . . . . 0.691 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' H THR . . . . . 0.974 ' O ' HD12 ' H' ' 123' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.264 1.839 0 N-CA-C 100.25 -3.982 . . . . 50.0 100.25 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' G PHE . . . . . 0.832 ' CD2' ' N ' ' L' ' 1' F GLY 0.26 22.8 p90 -67.84 -141.19 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 128.064 3.792 . . . . 50.0 114.506 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 1' F GLY . . . . . 0.832 ' N ' ' CD2' ' L' ' 1' G PHE . . . -22.86 106.88 0.01 OUTLIER Glycine 0 N--CA 1.477 1.418 1 CA-C-O 112.712 -4.382 . . . . 50.0 107.443 179.916 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 1' E SER . . . . . 1.142 ' HA ' ' O ' ' H' ' 123' ' ' LEU . 4.7 t 33.89 83.5 0.02 OUTLIER 'General case' 0 C--O 1.264 1.861 0 O-C-N 128.811 3.301 . . . . 50.0 112.758 177.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' D GLY . . . . . 0.706 ' CA ' ' O ' ' H' ' 529' ' ' HOH . . . 29.63 -143.78 0.01 OUTLIER Glycine 0 C--O 1.259 1.68 0 O-C-N 128.557 3.661 . . . . 50.0 111.374 -178.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' C GLU . . . . . 1.455 ' CG ' ' H ' ' L' ' 1' B ALA . 0.5 OUTLIER -71.21 -148.66 0.02 OUTLIER 'General case' 0 C--O 1.26 1.655 1 N-CA-C 123.761 4.726 . . . . 50.0 123.761 -174.516 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' L' L ' 1' B ALA . . . . . 1.455 ' H ' ' CG ' ' L' ' 1' C GLU . . . -101.5 -60.15 1.58 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 129.453 3.101 . . . . 48.03 107.538 -175.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' A ASP . . . . . 0.731 ' OD2' ' HE3' ' L' ' 9' ' ' LYS . 17.0 t0 -103.91 21.92 15.47 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 110.839 -2.891 . . . . 50.0 109.584 175.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 1' ' ' CYS . . . . . 0.909 ' HB3' ' HB3' ' L' ' 1' C GLU . 25.2 p -55.2 144.11 25.47 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.482 -1.287 . . . . 29.4 113.49 -173.955 67.354 79.693 96.047 102.158 2.006 104.621 -52.627 -68.329 2 2 . 1 . 001 ecloud build full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.46 7.9 42.54 Favored Glycine 0 C--O 1.265 2.06 1 N-CA-C 127.98 5.952 . . . . 19.21 127.98 174.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . 0.608 ' O ' ' CD2' ' H' ' 119' ' ' HIS . 54.6 mt -111.78 102.64 10.91 Favored 'General case' 0 C--O 1.256 1.409 0 N-CA-C 102.159 -3.275 . . . . 17.79 102.159 178.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 4' ' ' ARG . . . . . 0.64 ' NH2' ' OE2' ' L' ' 14' C GLU . 6.3 mtm180 -75.94 133.36 72.78 Favored Pre-proline 0 C--O 1.263 1.814 1 CA-C-N 106.936 -4.666 . . . . 19.0 110.455 -177.123 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.61 -33.23 96.29 Favored 'Trans proline' 0 CA--C 1.479 -2.245 0 O-C-N 128.09 3.679 . . . . 26.53 112.775 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 mp -99.85 5.63 45.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 119.896 -1.752 . . . . 26.69 115.246 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -134.21 -74.75 0.47 Allowed 'General case' 0 C--N 1.316 -0.861 0 O-C-N 120.865 -1.147 . . . . 26.9 111.077 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 8' ' ' GLU . . . . . 0.697 ' OE2' ' HE3' ' H' ' 202' ' ' LYS . 10.1 mp0 -56.74 -58.29 8.74 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 115.376 -2.25 . . . . 26.47 110.994 -179.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.731 ' HE3' ' OD2' ' L' ' 1' A ASP . 6.4 mttt -53.84 -14.19 0.91 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 128.232 3.457 . . . . 28.06 114.994 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . 0.258 82.1 mttt -125.54 -2.72 7.36 Favored 'General case' 0 C--O 1.211 -0.937 0 CA-C-O 114.556 -2.64 . . . . 35.51 108.381 -176.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 11' ' ' SER . . . . . . . . . . . . 0.368 10.1 t 66.72 42.7 2.59 Favored 'General case' 0 C--O 1.267 1.995 1 O-C-N 134.443 7.34 . . . . 26.32 113.028 178.954 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 43.1 mt -113.84 142.11 46.5 Favored 'General case' 0 C--N 1.362 1.13 0 CA-C-O 112.032 -3.842 . . . . 27.34 108.673 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.39 6.5 mt-10 -99.64 148.86 23.88 Favored 'General case' 0 C--O 1.251 1.178 1 CA-C-O 110.668 -4.492 . . . . 46.84 111.893 176.816 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' L' L ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' C ' ' L' ' 14' ' ' ASP . 5.6 p30 -84.46 163.51 19.4 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 127.045 2.716 . . . . 27.27 105.297 175.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' A LYS . . . . . 0.943 ' HG3' ' OE2' ' H' ' 23' ' ' GLU . 0.0 OUTLIER -60.72 -17.43 48.34 Favored 'General case' 0 C--O 1.263 1.804 1 CA-C-O 111.38 -4.152 . . . . 41.68 113.891 -171.338 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' L' L ' 14' B THR . . . . . 0.648 ' O ' ' HD3' ' L' ' 14' D ARG 0.251 77.7 p -124.43 -11.31 7.39 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 114.394 -2.922 . . . . 31.81 115.584 -179.257 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' C GLU . . . . . 0.64 ' OE2' ' NH2' ' L' ' 4' ' ' ARG 0.316 31.3 mt-10 -34.44 -47.31 0.3 Allowed 'General case' 0 N--CA 1.474 0.773 0 O-C-N 124.206 0.941 . . . . 33.79 111.287 176.421 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' D ARG . . . . . 1.127 ' HD3' ' N ' ' L' ' 14' E GLU . 0.0 OUTLIER -37.74 -51.18 1.25 Allowed 'General case' 0 C--N 1.395 2.577 0 C-N-CA 114.918 -2.713 . . . . 50.0 110.075 179.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' E GLU . . . . . 1.127 ' N ' ' HD3' ' L' ' 14' D ARG . 10.8 tt0 -44.88 -53.47 7.51 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 111.32 -2.673 . . . . 40.66 110.455 -171.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' F LEU . . . . . 0.607 HD12 ' N ' ' L' ' 14' F LEU . 5.3 mp -50.39 -63.57 1.08 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-N 112.371 -2.195 . . . . 29.29 109.724 177.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' G LEU . . . . . 0.793 ' O ' ' HA ' ' L' ' 14' L ASP . 3.6 mm? -50.56 -45.54 57.1 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 124.901 1.376 . . . . 28.69 113.724 -178.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' H GLU . . . . . 0.737 ' HG3' ' O ' ' L' ' 14' D ARG . 92.1 mt-10 -60.63 -16.41 38.39 Favored 'General case' 0 C--N 1.296 -1.733 1 CA-C-O 110.98 -4.343 . . . . 50.0 115.732 -175.77 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 14' I SER . . . . . 0.709 ' C ' ' N ' ' L' ' 14' K ILE . 59.6 p -94.87 -29.64 14.6 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 127.931 3.27 . . . . 33.11 113.23 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' J TYR . . . . . 0.641 ' C ' HG13 ' L' ' 14' K ILE . 4.9 m-30 -76.29 39.46 0.2 Allowed 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 102.798 -3.038 . . . . 39.92 102.798 179.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' K ILE . . . . . 0.709 ' N ' ' C ' ' L' ' 14' I SER . 0.1 OUTLIER 29.06 48.63 0.12 Allowed 'Isoleucine or valine' 1 C--N 1.124 -9.229 2 CA-C-N 102.217 -6.81 . . . . 49.83 109.009 -158.533 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' L' L ' 14' L ASP . . . . . 1.368 ' C ' ' N ' ' L' ' 14' M GLY . 7.6 m-20 87.08 163.5 0.08 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 129.044 3.965 . . . . 50.0 109.936 -179.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 14' M GLY . . . . . 1.368 ' N ' ' C ' ' L' ' 14' L ASP . . . -70.36 -156.89 1.86 Allowed Glycine 1 C--N 1.743 23.184 2 O-C-N 97.449 -15.782 . . . . 50.0 121.084 -165.201 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' L' L ' 15' ' ' ARG . . . . . 0.492 ' OXT' ' O ' ' L' ' 14' M GLY . . . . . . . . 0 C--O 1.282 2.811 0 CA-C-O 114.415 -2.707 . . . . 50.0 108.372 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' ILE . . . . . 0.425 ' N ' ' OD2' ' H' ' 194' ' ' ASP . 33.2 mm . . . . . 0 C--O 1.261 1.678 0 N-CA-C 103.568 -2.753 . . . . 21.21 103.568 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' VAL . . . . . 1.006 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 74.1 t -108.93 130.46 61.79 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 128.339 3.924 . . . . 27.37 110.143 178.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 18' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' H' ' 17' ' ' VAL . 4.2 mm-40 60.61 49.12 6.72 Favored 'General case' 0 C--N 1.312 -1.023 1 O-C-N 115.341 -4.599 . . . . 41.48 113.615 -179.137 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.1 -175.67 14.08 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-O 116.127 -2.485 . . . . 32.73 108.191 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.92 179.98 3.9 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 118.992 1.396 . . . . 38.32 111.351 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 21' ' ' ASP . . . . . 0.949 ' HB3' ' CG1' ' H' ' 154' ' ' VAL . 26.5 m-20 -82.95 130.43 35.14 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 126.961 2.663 . . . . 35.52 105.51 177.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 22' ' ' ALA . . . . . 0.84 ' HB2' ' CG1' ' H' ' 157' ' ' VAL . . . -60.33 147.74 39.44 Favored 'General case' 0 C--N 1.279 -2.474 0 O-C-N 128.493 3.621 . . . . 29.58 109.974 178.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 23' ' ' GLU . . . . . 0.943 ' OE2' ' HG3' ' L' ' 14' A LYS . 22.4 mt-10 -70.55 159.1 34.94 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-N 121.897 2.135 . . . . 32.7 110.423 170.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mm -65.37 139.11 21.9 Favored 'Isoleucine or valine' 0 C--O 1.259 1.587 0 N-CA-C 103.164 -2.902 . . . . 21.89 103.164 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 50.21 34.19 24.57 Favored Glycine 0 N--CA 1.421 -2.304 1 C-N-CA 137.641 7.305 . . . . 18.4 112.75 -174.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 5.0 ttt -79.84 -21.41 44.2 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 127.457 2.303 . . . . 24.71 111.624 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.253 0.2 OUTLIER -137.61 65.02 46.44 Favored Pre-proline 0 C--N 1.317 -0.815 0 C-N-CA 127.632 2.373 . . . . 26.28 111.763 -179.392 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 28' ' ' PRO . . . . . 0.516 ' CG ' ' HG2' ' L' ' 4' ' ' ARG . 2.6 Cg_endo -60.81 -12.23 21.06 Favored 'Trans proline' 0 C--O 1.27 2.093 0 C-N-CA 122.095 1.864 . . . . 17.65 113.799 -177.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -99.56 -2.32 36.03 Favored 'General case' 0 C--O 1.269 2.095 0 CA-C-O 116.562 -1.685 . . . . 18.05 113.307 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 30' ' ' GLN . . . . . 0.608 ' OE1' ' OG1' ' H' ' 139' ' ' THR . 64.3 tp60 -72.31 121.38 19.36 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 129.103 2.961 . . . . 19.85 107.11 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 96.8 t -120.96 139.64 47.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 O-C-N 126.508 2.38 . . . . 22.52 110.246 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 32' ' ' MET . . . . . 0.729 ' HG3' HD13 ' H' ' 40' ' ' LEU . 47.2 ttm -103.35 118.79 37.57 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 113.87 -2.967 . . . . 24.5 105.995 -177.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . 0.399 0.0 OUTLIER -84.7 119.93 25.82 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 104.241 -2.503 . . . . 34.4 104.241 173.436 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 34' ' ' PHE . . . . . 0.453 ' HE2' ' HG2' ' H' ' 38' ' ' GLN . 47.8 t80 -125.38 130.78 52.59 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.02 -0.536 . . . . 31.62 111.461 -171.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 35' ' ' ARG . . . . . 0.79 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 29.1 ttt180 -78.64 128.78 33.96 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 125.154 2.407 . . . . 41.68 109.201 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' ' ' LYS . . . . . 0.785 ' O ' ' HG3' ' H' ' 38' ' ' GLN . 10.4 mtpt -63.8 -41.1 97.98 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 115.704 -2.398 . . . . 41.82 115.194 178.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.1 OUTLIER -152.21 108.03 2.81 Favored Pre-proline 0 C--O 1.275 2.436 0 CA-C-O 116.204 -1.855 . . . . 50.0 115.568 -173.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 37' ' ' PRO . . . . . 0.711 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 3.6 Cg_endo -64.05 135.3 20.42 Favored 'Cis proline' 0 N--CA 1.445 -1.379 0 CA-C-N 121.236 1.477 . . . . 44.65 108.819 -2.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 38' ' ' GLN . . . . . 0.79 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 5.4 mt-30 -63.51 104.19 0.61 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 112.118 -3.801 . . . . 47.38 106.971 -178.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 39' ' ' GLU . . . . . 0.711 ' HG2' ' O ' ' H' ' 37' ' ' PRO . 5.7 pt-20 -154.4 150.88 28.36 Favored 'General case' 0 C--N 1.322 -0.625 1 O-C-N 133.189 6.556 . . . . 47.29 116.242 -178.432 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 40' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' H' ' 32' ' ' MET . 41.1 tp -67.04 118.76 10.93 Favored 'General case' 0 N--CA 1.433 -1.294 1 CA-C-O 111.002 -4.332 . . . . 35.35 107.713 178.788 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 41' ' ' LEU . . . . . 0.456 HD13 ' CE2' ' H' ' 60' H PHE . 11.9 mt -89.23 -52.46 5.04 Favored 'General case' 0 C--N 1.312 -1.028 1 O-C-N 129.683 4.364 . . . . 35.94 109.1 176.835 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 42' ' ' CYS . . . . . 0.511 ' HB3' ' O ' ' H' ' 195' ' ' SER . 93.9 m -163.46 -176.8 4.91 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 125.336 1.454 . . . . 24.3 111.662 -173.276 -65.072 -170.382 -101.332 96.315 2.203 99.781 -84.356 -69.737 2 2 . 1 . 001 ecloud build full ' H' H ' 43' ' ' GLY . . . . . 0.507 ' O ' ' HB2' ' H' ' 44' ' ' ALA . . . -96.92 -164.23 32.56 Favored Glycine 0 C--O 1.252 1.242 0 N-CA-C 107.41 -2.276 . . . . 17.59 107.41 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 44' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' H' ' 43' ' ' GLY . . . 169.17 164.93 0.05 OUTLIER 'General case' 0 C--O 1.272 2.253 0 O-C-N 118.764 -2.61 . . . . 16.93 106.102 -174.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 60.3 p -131.05 145.01 51.87 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 117.044 -1.862 . . . . 24.36 108.467 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 46' ' ' LEU . . . . . 0.538 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -89.45 125.01 35.0 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 113.789 -3.005 . . . . 20.65 103.685 -178.752 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.266 42.4 pt -119.12 6.42 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 1 O-C-N 130.03 4.581 . . . . 25.88 112.941 -178.318 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 48' ' ' SER . . . . . 0.538 ' O ' HD22 ' H' ' 46' ' ' LEU . 1.0 OUTLIER -179.01 -174.88 0.36 Allowed 'General case' 0 C--O 1.266 1.961 1 CA-C-O 111.453 -4.118 . . . . 29.07 104.284 176.044 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 49' ' ' ASP . . . . . 0.854 ' O ' HG23 ' H' ' 112' ' ' VAL . 21.2 p-10 -82.98 -7.96 59.61 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 124.136 3.153 . . . . 36.28 113.149 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 50' ' ' ARG . . . . . 1.093 ' HG3' ' CG ' ' H' ' 247' ' ' GLU . 7.8 mmm180 -114.98 -11.62 12.12 Favored 'General case' 0 C--O 1.261 1.703 0 N-CA-C 115.221 1.563 . . . . 40.11 115.221 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 51' ' ' TRP . . . . . 0.542 ' CZ3' ' HB3' ' H' ' 107' ' ' LYS . 90.0 m95 -121.4 140.48 52.09 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 125.703 2.668 . . . . 33.38 113.607 -177.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.48 141.85 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 110.912 -2.858 . . . . 22.4 109.332 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 53' ' ' LEU . . . . . 0.407 HD11 HG13 ' H' ' 103' ' ' ILE . 14.0 tp -120.6 135.88 54.97 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 121.176 1.807 . . . . 20.64 109.834 179.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -150.66 175.27 12.1 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.398 -2.183 . . . . 25.33 112.449 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.39 143.47 48.54 Favored 'General case' 0 N--CA 1.52 3.051 1 CA-C-O 111.697 -4.001 . . . . 21.07 110.982 -178.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 56' ' ' ALA . . . . . 0.775 ' CB ' HG23 ' H' ' 90' ' ' ILE . . . -66.6 -25.04 66.43 Favored 'General case' 0 N--CA 1.492 1.639 1 CA-C-N 126.583 4.265 . . . . 18.77 110.732 172.619 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' OG ' ' H' ' 195' ' ' SER 0.297 5.6 p-80 -67.45 -19.17 65.33 Favored 'General case' 0 C--O 1.274 2.352 1 O-C-N 115.848 -4.283 . . . . 23.53 110.364 -177.307 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 96.7 m -59.94 -25.63 65.33 Favored 'General case' 0 C--O 1.289 3.18 0 CA-C-N 124.836 3.471 . . . . 25.26 114.113 172.289 -69.737 -84.356 -101.332 99.781 2.203 96.315 -170.382 -65.072 1 1 . 1 . 001 ecloud build full ' H' H ' 59' ' ' LEU . . . . . 0.64 HD22 HD13 ' H' ' 88' ' ' ILE . 9.3 mt -104.15 -39.4 6.54 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.437 -2.04 . . . . 26.66 113.84 -175.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' ' ' LEU . . . . . 0.556 HD13 ' OD1' ' H' ' 60' G ASN . 18.9 tp -137.6 125.85 23.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.718 3.207 . . . . 28.86 114.491 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' A TYR . . . . . 0.816 ' C ' ' HD2' ' H' ' 60' C PRO . 15.3 t80 -161.19 77.26 2.38 Favored Pre-proline 0 N--CA 1.48 1.056 0 N-CA-C 102.332 -3.21 . . . . 37.73 102.332 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' B PRO . . . . . 0.836 ' N ' ' HD2' ' H' ' 60' C PRO . 3.0 Cg_exo -53.51 -32.43 63.35 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.977 1.785 . . . . 32.16 114.017 -169.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' C PRO . . . . . 0.836 ' HD2' ' N ' ' H' ' 60' B PRO . 6.2 Cg_exo -64.17 -25.96 65.13 Favored 'Trans proline' 0 N--CA 1.425 -2.541 1 C-N-CA 126.214 4.609 . . . . 35.31 116.2 -178.704 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 60' D TRP . . . . . 0.816 ' CZ2' ' H13' ' J' ' 3' ' ' PRJ . 29.9 m0 -112.31 21.44 15.76 Favored 'General case' 0 C--N 1.307 -1.253 2 N-CA-C 95.719 -5.659 . . . . 41.97 95.719 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 60' E ASP . . . . . . . . . . . . 0.289 10.7 m-20 61.96 13.03 5.28 Favored 'General case' 0 N--CA 1.504 2.239 1 N-CA-C 122.089 4.107 . . . . 41.33 122.089 178.733 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 60' F LYS . . . . . 0.583 ' HD3' ' CE2' ' H' ' 60' H PHE . 4.1 ttpt -90.34 123.66 34.27 Favored 'General case' 0 C--O 1.253 1.26 0 CA-C-O 128.027 3.775 . . . . 32.69 114.265 178.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' G ASN . . . . . 0.556 ' OD1' HD13 ' H' ' 60' ' ' LEU . 62.9 t30 -150.45 70.72 1.03 Allowed 'General case' 0 C--O 1.253 1.277 0 CA-C-N 109.484 -3.507 . . . . 43.6 113.285 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' H PHE . . . . . 0.583 ' CE2' ' HD3' ' H' ' 60' F LYS . 31.4 m-85 -69.24 129.72 40.62 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 126.497 3.046 . . . . 36.4 113.099 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 60' I THR . . . . . 0.772 HG23 ' CG ' ' H' ' 63' ' ' ASP . 0.6 OUTLIER -94.68 166.27 12.09 Favored 'General case' 0 C--N 1.291 -1.946 0 C-N-CA 131.002 3.721 . . . . 43.48 107.585 174.643 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 61' ' ' GLU . . . . . 0.687 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.0 OUTLIER -57.46 -48.11 80.04 Favored 'General case' 0 C--O 1.259 1.603 0 CA-C-N 112.686 -2.052 . . . . 50.0 116.157 -178.686 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 62' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -90.38 29.96 1.2 Allowed 'General case' 0 C--O 1.217 -0.643 0 O-C-N 118.099 -2.876 . . . . 50.0 111.248 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 63' ' ' ASP . . . . . 0.772 ' CG ' HG23 ' H' ' 60' I THR . 1.0 OUTLIER -98.31 -23.96 15.42 Favored 'General case' 0 C--N 1.284 -2.246 0 O-C-N 127.113 2.758 . . . . 44.56 109.304 178.738 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 64' ' ' LEU . . . . . 0.438 ' O ' ' O ' ' H' ' 460' ' ' HOH 0.33 9.2 mt -120.66 160.29 23.57 Favored 'General case' 0 C--O 1.262 1.713 2 O-C-N 132.506 6.129 . . . . 36.27 123.067 -174.583 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 65' ' ' LEU . . . . . 0.733 HD11 ' CE ' ' H' ' 84' ' ' MET . 0.0 OUTLIER -128.61 157.31 41.63 Favored 'General case' 0 C--N 1.318 -0.778 1 CA-C-O 110.52 -4.562 . . . . 28.98 106.897 169.904 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -113.07 139.3 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-O 113.251 -3.262 . . . . 26.74 102.462 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 67' ' ' ARG . . . . . 0.768 ' HD3' ' HD2' ' H' ' 70' ' ' LYS . 51.2 mtt180 -113.78 121.36 43.82 Favored 'General case' 0 C--O 1.283 2.837 0 CA-C-O 113.316 -3.231 . . . . 37.22 110.45 174.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.93 142.4 34.15 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.118 0 CA-C-N 122.629 2.468 . . . . 26.98 113.356 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 69' ' ' GLY . . . . . 1.049 ' O ' HD11 ' H' ' 79' ' ' ILE . . . 101.09 6.99 50.95 Favored Glycine 0 C--O 1.258 1.641 1 O-C-N 115.351 -4.593 . . . . 25.84 108.374 178.11 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 70' ' ' LYS . . . . . 0.768 ' HD2' ' HD3' ' H' ' 67' ' ' ARG . 2.2 mtpp -78.73 156.68 28.78 Favored 'General case' 0 C--N 1.353 0.739 0 O-C-N 129.299 3.588 . . . . 24.39 108.171 -176.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 71' ' ' HIS . . . . . 0.492 ' CD2' HG22 ' H' ' 154' ' ' VAL . 76.0 t60 -136.76 -50.62 0.66 Allowed 'General case' 0 N--CA 1.483 1.2 1 CA-C-O 129.531 4.491 . . . . 24.17 102.514 175.859 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 72' ' ' SER . . . . . 0.414 ' O ' ' CE ' ' H' ' 70' ' ' LYS . 5.0 t -73.06 137.83 45.55 Favored 'General case' 0 N--CA 1.486 1.349 1 O-C-N 115.799 -4.313 . . . . 28.12 107.487 177.951 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 73' ' ' ARG . . . . . 0.498 ' CZ ' ' HB3' ' H' ' 151' ' ' GLN . 55.6 ttp85 -63.04 -52.21 63.75 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 128.947 3.904 . . . . 35.3 113.949 176.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 74' ' ' THR . . . . . 0.691 ' O ' ' O ' ' H' ' 615' ' ' HOH . 20.5 p -109.96 -19.3 13.14 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 119.953 3.316 . . . . 30.72 119.953 -176.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ARG . . . . . 0.897 ' HD3' ' OE1' ' I' ' 357' ' ' GLU . 11.7 mmt180 -72.96 151.07 42.0 Favored 'General case' 0 CA--C 1.493 -1.248 0 O-C-N 118.209 -2.807 . . . . 45.43 115.68 178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -90.37 110.27 21.36 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 115.647 -2.12 . . . . 41.19 106.39 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -85.17 81.05 9.0 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-O 127.568 3.556 . . . . 31.98 109.673 -174.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' A ARG . . . . . 0.452 ' O ' ' HG3' ' H' ' 77' A ARG . 9.8 ttp85 -32.91 -47.24 0.17 Allowed 'General case' 0 C--O 1.288 3.106 2 CA-C-O 106.823 -6.323 . . . . 38.36 115.866 -173.18 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 78' ' ' ASN . . . . . 0.761 ' N ' ' O ' ' H' ' 453' ' ' HOH . 28.3 m120 -127.32 23.18 6.44 Favored 'General case' 0 N--CA 1.493 1.715 1 CA-C-N 127.396 4.634 . . . . 33.42 110.916 175.635 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 79' ' ' ILE . . . . . 1.049 HD11 ' O ' ' H' ' 69' ' ' GLY 0.45 0.5 OUTLIER -109.95 -53.14 5.95 Favored 'Isoleucine or valine' 0 C--O 1.26 1.628 0 CA-C-O 114.079 -2.867 . . . . 36.07 109.666 179.5 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 80' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' H' ' 70' ' ' LYS . 8.6 pt-20 -89.14 153.99 20.51 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 113.528 -3.13 . . . . 30.79 113.402 -175.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 81' ' ' LYS . . . . . 0.601 ' HE3' ' O ' ' H' ' 468' ' ' HOH . 0.8 OUTLIER -127.19 134.45 50.14 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 121.04 1.746 . . . . 46.46 107.323 177.691 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 mt -103.95 134.86 44.05 Favored 'Isoleucine or valine' 0 C--O 1.269 2.124 0 CA-C-O 112.553 -3.594 . . . . 33.11 110.502 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -135.07 156.04 49.71 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 122.044 2.202 . . . . 33.69 110.051 179.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 84' ' ' MET . . . . . 0.733 ' CE ' HD11 ' H' ' 65' ' ' LEU . 0.1 OUTLIER -96.94 156.27 16.42 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 128.625 3.703 . . . . 50.0 101.22 -178.35 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 85' ' ' LEU . . . . . 0.668 HD13 ' HE2' ' H' ' 106' ' ' MET . 0.3 OUTLIER -105.6 149.02 26.67 Favored 'General case' 0 C--N 1.317 -0.84 1 O-C-N 129.663 4.352 . . . . 35.52 107.157 178.817 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -99.09 -40.03 8.21 Favored 'General case' 0 C--N 1.309 -1.187 1 CA-C-N 105.723 -5.217 . . . . 49.34 107.862 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 87' ' ' LYS . . . . . 0.801 ' HE3' ' H ' ' H' ' 88' ' ' ILE . 0.1 OUTLIER -154.25 156.28 36.75 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 120.638 1.563 . . . . 41.1 109.924 -178.38 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 88' ' ' ILE . . . . . 0.801 ' H ' ' HE3' ' H' ' 87' ' ' LYS . 14.6 mt -129.25 130.39 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 O-C-N 128.391 3.557 . . . . 35.99 102.517 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 89' ' ' TYR . . . . . 0.726 ' CE2' ' CE1' ' H' ' 245' ' ' PHE . 82.0 m-85 -133.55 117.78 17.51 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 112.123 -3.798 . . . . 38.96 106.083 -177.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 90' ' ' ILE . . . . . 0.775 HG23 ' CB ' ' H' ' 56' ' ' ALA . 2.4 mm -100.66 151.28 5.28 Favored 'Isoleucine or valine' 0 C--O 1.25 1.1 1 O-C-N 129.467 4.229 . . . . 30.91 105.868 178.721 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -60.66 127.52 87.16 Favored Pre-proline 0 N--CA 1.487 1.391 0 O-C-N 127.83 3.206 . . . . 27.63 106.086 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -58.38 -18.81 40.25 Favored 'Trans proline' 0 C--O 1.269 2.058 0 C-N-CA 121.142 1.228 . . . . 29.74 111.994 -177.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -115.42 21.08 14.36 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 115.839 -2.029 . . . . 37.09 114.128 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' TYR . . . . . 0.552 ' HE1' HD22 ' H' ' 99' ' ' LEU . 1.1 t80 -57.77 121.79 11.29 Favored 'General case' 0 C--O 1.266 1.953 0 O-C-N 125.746 1.904 . . . . 24.57 109.814 171.138 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -87.12 84.43 7.28 Favored 'General case' 0 C--O 1.275 2.431 0 O-C-N 119.463 -2.023 . . . . 24.7 115.078 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -76.45 -18.61 58.7 Favored 'General case' 0 N--CA 1.504 2.255 1 C-N-CA 111.562 -4.055 . . . . 30.9 111.793 176.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -70.81 -40.82 72.28 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 126.814 2.046 . . . . 47.61 115.718 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' A GLU . . . . . 0.411 ' OE1' ' NH2' ' H' ' 175' ' ' ARG . 15.3 tt0 -116.28 -71.84 0.72 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 118.286 -1.365 . . . . 45.36 111.068 -179.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 98' ' ' ASN . . . . . 0.681 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 41.5 p-10 -119.96 20.4 12.17 Favored 'General case' 0 C--N 1.406 3.055 0 CA-C-O 113.345 -3.217 . . . . 23.73 119.012 -173.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 99' ' ' LEU . . . . . 0.552 HD22 ' HE1' ' H' ' 94' ' ' TYR . 4.9 mt 62.05 27.08 16.36 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 124.464 3.302 . . . . 27.27 112.093 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 100' ' ' ASP . . . . . 0.416 ' CG ' HG21 ' H' ' 177' ' ' THR . 16.7 t0 -58.76 131.12 49.95 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 104.454 -2.424 . . . . 24.12 104.454 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 65.61 40.36 4.53 Favored 'General case' 0 C--O 1.267 2.018 0 O-C-N 126.39 2.306 . . . . 35.52 115.134 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' ASP . . . . . 0.573 ' OD2' ' OG ' ' H' ' 214' ' ' SER . 44.3 t0 -77.08 83.36 3.58 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 113.366 -1.743 . . . . 17.7 107.622 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ILE . . . . . 0.874 HG21 HD12 ' H' ' 234' ' ' LEU . 2.3 tt -158.26 137.7 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 129.437 3.095 . . . . 19.65 109.766 -173.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.13 150.65 20.43 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 102.741 -3.059 . . . . 20.0 102.741 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 10.1 mt -120.01 133.64 55.48 Favored 'General case' 0 C--O 1.253 1.274 0 C-N-CA 128.58 2.752 . . . . 24.95 109.491 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' MET . . . . . 0.668 ' HE2' HD13 ' H' ' 85' ' ' LEU . 39.8 mtp -117.49 116.8 27.86 Favored 'General case' 0 C--O 1.27 2.154 1 O-C-N 132.018 5.824 . . . . 32.35 107.378 175.545 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 107' ' ' LYS . . . . . 0.945 ' CD ' HH21 ' H' ' 50' ' ' ARG . 0.0 OUTLIER -100.42 125.06 46.66 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 104.05 -2.574 . . . . 50.0 104.05 178.574 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 19.3 mt -71.25 145.55 49.53 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 127.06 2.725 . . . . 34.31 112.241 -168.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -20.81 64.47 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 122.655 1.217 . . . . 50.0 113.219 -179.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 110' ' ' LYS . . . . . 1.079 ' HG3' ' HD2' ' H' ' 111' ' ' PRO . 9.9 tptm -156.91 149.49 18.07 Favored Pre-proline 0 N--CA 1.468 0.455 0 C-N-CA 124.688 1.195 . . . . 49.93 109.063 177.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . 1.079 ' HD2' ' HG3' ' H' ' 110' ' ' LYS . 2.4 Cg_endo -65.51 154.81 72.03 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 O-C-N 125.083 2.096 . . . . 36.67 107.106 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 112' ' ' VAL . . . . . 0.854 HG23 ' O ' ' H' ' 49' ' ' ASP . 0.2 OUTLIER -103.4 159.78 4.68 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 C-N-CA 126.688 1.995 . . . . 35.22 106.902 179.631 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -107.92 139.77 42.05 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 110.391 -3.095 . . . . 31.13 103.355 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' PHE . . . . . 0.792 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 11.4 m-30 -82.75 167.46 18.14 Favored 'General case' 0 C--O 1.265 1.878 1 O-C-N 131.047 5.217 . . . . 28.61 107.153 -174.191 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 115' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' H' ' 116' ' ' ASP . 0.6 OUTLIER -167.52 -168.11 0.98 Allowed 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 101.65 -3.463 . . . . 26.89 101.65 -172.074 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . 0.597 ' N ' ' OG ' ' H' ' 115' ' ' SER . 84.5 m-20 -77.73 -11.39 59.87 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 126.972 2.67 . . . . 35.01 111.064 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -107.68 -20.25 13.28 Favored 'General case' 0 C--O 1.252 1.206 1 O-C-N 131.518 5.511 . . . . 26.4 113.898 -175.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 118' ' ' ILE . . . . . 0.531 ' CD1' ' HD3' ' H' ' 81' ' ' LYS . 9.7 mt -123.68 107.45 18.91 Favored 'Isoleucine or valine' 0 C--O 1.256 1.409 1 C-N-CA 133.596 4.758 . . . . 22.07 115.102 -176.309 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 119' ' ' HIS . . . . . 0.608 ' CD2' ' O ' ' L' ' 3' ' ' LEU . 51.9 t60 -148.21 135.94 10.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 112.243 -2.253 . . . . 27.27 109.949 -175.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -74.55 156.24 45.05 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 CA-C-N 124.03 2.475 . . . . 21.13 116.321 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' VAL . . . . . 0.41 HG11 ' HB2' ' H' ' 209' ' ' GLN . 3.4 p -96.15 158.72 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 118.211 -2.805 . . . . 17.99 106.535 177.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 122' ' ' CYS . . . . . 0.529 ' HA ' ' HA3' ' L' ' 1' D GLY . 91.0 m -90.87 147.5 23.12 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 113.077 -3.344 . . . . 17.81 110.644 -179.775 -68.329 -52.627 96.047 104.621 2.006 102.158 79.693 67.354 2 2 . 1 . 001 ecloud build full ' H' H ' 123' ' ' LEU . . . . . 1.142 ' O ' ' HA ' ' L' ' 1' E SER . 93.6 mt -93.47 140.64 23.23 Favored Pre-proline 0 C--N 1.298 -1.669 0 N-CA-C 104.37 -2.456 . . . . 21.93 104.37 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 124' ' ' PRO . . . . . 0.838 ' O ' ' NZ ' ' H' ' 235' ' ' LYS . 1.4 Cg_endo -72.2 153.2 56.7 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 123.167 2.578 . . . . 25.1 114.218 -174.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 125' ' ' ASP . . . . . 0.601 ' O ' ' N ' ' H' ' 127' ' ' GLU . 3.5 p30 -103.8 149.26 25.2 Favored 'General case' 0 C--O 1.273 2.296 0 O-C-N 126.272 2.232 . . . . 37.88 110.161 172.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . 0.597 ' C ' ' O ' ' H' ' 125' ' ' ASP . 48.7 ttt-85 -34.81 -33.96 0.03 OUTLIER 'General case' 0 C--O 1.251 1.153 1 O-C-N 116.078 -4.139 . . . . 50.0 112.716 -178.339 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 127' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' H' ' 125' ' ' ASP . 0.2 OUTLIER -84.07 -36.12 23.27 Favored 'General case' 0 C--O 1.266 1.951 0 CA-C-N 122.99 2.632 . . . . 44.66 114.38 -174.158 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 92.0 m -66.4 -45.5 79.75 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 112.008 -2.36 . . . . 32.36 109.548 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.4 -46.8 83.08 Favored 'General case' 0 C--N 1.288 -2.078 2 C-N-CA 132.933 4.493 . . . . 31.08 107.349 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.18 -42.82 79.41 Favored 'General case' 0 C--O 1.257 1.483 0 O-C-N 117.105 -3.497 . . . . 32.86 110.551 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' B SER . . . . . . . . . . . . . 4.1 p -87.9 -5.86 58.36 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 125.306 3.684 . . . . 40.34 116.09 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' C LEU . . . . . . . . . . . . . 17.1 mt -107.34 -40.28 5.43 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.121 -1.418 . . . . 27.99 111.143 -174.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.31 73.39 0.97 Allowed 'General case' 0 N--CA 1.498 1.971 1 O-C-N 130.667 4.979 . . . . 30.23 110.889 -176.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 131' ' ' GLN . . . . . . . . . . . . . 61.4 mt-30 -135.22 139.28 44.37 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 125.886 2.755 . . . . 47.81 108.889 -176.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.34 138.67 58.25 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 113.61 -3.091 . . . . 30.2 103.164 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.15 -36.45 4.32 Favored Glycine 0 N--CA 1.48 1.581 1 O-C-N 135.239 7.837 . . . . 28.39 109.897 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -63.86 140.89 58.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 129.868 3.923 . . . . 32.92 108.905 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 135' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' H' ' 160' ' ' LEU . 82.3 mttt -100.29 142.18 32.12 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.494 1.517 . . . . 28.28 114.353 174.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 136' ' ' GLY . . . . . 0.516 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -121.43 -178.81 15.92 Favored Glycine 0 CA--C 1.553 2.421 1 C-N-CA 134.039 5.59 . . . . 18.99 105.163 -179.589 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -137.8 137.54 38.3 Favored 'General case' 0 N--CA 1.441 -0.884 1 CA-C-O 106.371 -6.538 . . . . 22.72 104.739 -172.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 1.4 t -122.12 154.82 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 1 O-C-N 134.585 7.428 . . . . 18.91 102.32 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 139' ' ' THR . . . . . 0.608 ' OG1' ' OE1' ' H' ' 30' ' ' GLN . 22.7 p -148.67 154.39 39.6 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 111.175 -2.739 . . . . 25.07 111.012 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 167.19 164.14 22.32 Favored Glycine 0 C--N 1.282 -2.438 2 O-C-N 131.043 5.214 . . . . 19.25 110.772 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 141' ' ' TRP . . . . . 0.445 ' CZ3' ' HB2' ' H' ' 32' ' ' MET . 8.8 m-90 -101.98 12.43 36.91 Favored 'General case' 0 C--O 1.251 1.183 0 O-C-N 129.404 3.649 . . . . 28.55 110.781 -179.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -68.4 -170.2 5.77 Favored Glycine 0 CA--C 1.54 1.656 2 O-C-N 109.301 -8.375 . . . . 27.84 111.523 -177.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -53.32 143.36 18.95 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-O 107.96 -5.781 . . . . 38.66 110.269 -176.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.15 -17.53 27.46 Favored 'General case' 0 C--N 1.307 -1.26 2 O-C-N 133.618 6.823 . . . . 32.26 109.636 177.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.322 0.2 OUTLIER -157.08 158.29 36.16 Favored 'General case' 0 N--CA 1.506 2.373 1 O-C-N 130.675 4.984 . . . . 50.0 106.547 177.422 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 146' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' H' ' 146' ' ' GLU . 77.2 tt0 -54.54 -32.15 57.73 Favored 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.254 3.471 . . . . 41.72 119.563 -171.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 147' ' ' THR . . . . . 0.654 HG22 ' O ' ' H' ' 521' ' ' HOH . 5.7 t . . . . . 0 C--O 1.294 3.409 1 C-N-CA 132.351 4.26 . . . . 46.31 101.908 -179.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 109.462 -1.455 . . . . 39.25 109.462 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 151' ' ' GLN . . . . . 0.498 ' HB3' ' CZ ' ' H' ' 73' ' ' ARG . 1.6 mt-30 -98.26 151.57 37.57 Favored Pre-proline 0 N--CA 1.479 1.018 0 N-CA-C 107.205 -1.406 . . . . 49.79 107.205 177.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 152' ' ' PRO . . . . . 0.456 ' O ' ' NE ' ' H' ' 73' ' ' ARG . 6.5 Cg_endo -87.19 161.5 8.52 Favored 'Trans proline' 0 C--N 1.293 -2.381 0 C-N-CA 123.394 2.729 . . . . 34.98 105.225 -169.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 11.2 p -91.41 -27.93 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 126.539 2.4 . . . . 27.21 107.008 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 154' ' ' VAL . . . . . 0.949 ' CG1' ' HB3' ' H' ' 21' ' ' ASP 0.299 1.2 t -118.0 157.27 19.42 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.954 0 CA-C-O 124.584 2.135 . . . . 25.79 112.8 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 39.7 tp -51.53 137.49 24.25 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-O 115.915 -1.993 . . . . 23.01 110.72 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 156' ' ' GLN . . . . . 0.727 ' C ' HG13 ' H' ' 157' ' ' VAL . 97.3 mm-40 -113.09 163.04 15.22 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 124.27 3.214 . . . . 18.96 107.358 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 157' ' ' VAL . . . . . 0.84 ' CG1' ' HB2' ' H' ' 22' ' ' ALA 0.269 6.1 m -145.53 147.13 18.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 2 O-C-N 129.611 4.32 . . . . 27.47 111.209 -179.965 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.25 149.47 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 1 O-C-N 130.328 4.767 . . . . 19.83 105.325 175.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 159' ' ' ASN . . . . . 0.492 ' CG ' HD11 ' L' ' 14' F LEU . 89.1 m-20 -107.52 134.57 50.35 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 111.81 -3.948 . . . . 25.13 103.471 -178.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 160' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' H' ' 135' ' ' LYS . 19.9 mt -129.88 151.91 79.01 Favored Pre-proline 0 C--N 1.275 -2.66 0 CA-C-O 126.482 3.039 . . . . 24.63 112.969 176.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -84.38 148.15 11.45 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 115.428 -2.985 . . . . 25.58 108.652 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.07 138.29 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.637 0 N-CA-C 101.584 -3.487 . . . . 27.59 101.584 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 85.2 t -114.35 145.5 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-O 124.657 2.17 . . . . 24.97 105.557 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -61.89 134.68 56.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 110.949 -2.841 . . . . 49.9 109.264 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 165' ' ' ARG . . . . . 0.828 ' HB2' ' HD3' ' H' ' 166' ' ' PRO . 0.1 OUTLIER -46.75 -57.17 9.48 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 126.303 1.841 . . . . 50.0 112.463 -173.974 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 166' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' H' ' 165' ' ' ARG . 4.6 Cg_exo -51.93 -43.89 49.01 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 124.677 3.585 . . . . 29.25 108.925 -178.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 50.7 t -59.17 -40.78 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 127.71 3.624 . . . . 28.37 107.649 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . 0.317 75.6 m -54.36 -65.79 0.51 Allowed 'General case' 0 C--O 1.252 1.228 0 O-C-N 118.651 -2.531 . . . . 27.72 109.46 -176.863 -63.54 -66.179 -81.336 107.71 1.992 105.156 -85.551 91.115 2 2 . 1 . 001 ecloud build full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . 0.355 3.6 mmtp -43.15 -53.55 4.93 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 126.865 2.066 . . . . 47.83 115.361 175.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.15 -8.0 1.39 Allowed 'General case' 0 C--N 1.31 -1.123 1 C-N-CA 133.318 4.647 . . . . 23.06 114.374 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 19.7 p -108.68 -6.9 15.76 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 127.645 3.09 . . . . 24.21 111.588 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.313 2.1 t -145.98 178.18 8.39 Favored 'General case' 1 C--O 1.306 4.056 0 N-CA-C 106.266 -1.754 . . . . 22.0 106.266 -179.834 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' H' H ' 173' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' H' ' 173' ' ' ARG 0.264 8.5 mtp180 -114.59 -3.1 12.96 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 111.459 -2.61 . . . . 45.78 109.646 177.98 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 8.2 mm -79.62 140.69 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 1 O-C-N 129.561 4.288 . . . . 22.43 107.115 176.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 175' ' ' ARG . . . . . 0.681 ' O ' ' ND2' ' H' ' 98' ' ' ASN . 35.2 ttp85 -82.54 118.36 23.21 Favored 'General case' 0 N--CA 1.512 2.67 0 CA-C-O 128.455 3.978 . . . . 29.95 110.076 176.38 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 176' ' ' ILE . . . . . 0.486 HD11 ' CH2' ' H' ' 215' ' ' TRP 0.296 1.1 mm -81.43 128.39 38.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 2 C-N-CA 136.267 5.827 . . . . 25.93 107.681 -178.897 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 177' ' ' THR . . . . . 0.631 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.3 p -111.89 163.35 14.31 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.094 -3.504 . . . . 29.73 108.712 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.58 -25.06 6.15 Favored 'General case' 0 C--N 1.306 -1.297 1 C-N-CA 133.451 4.7 . . . . 30.76 113.187 175.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -74.43 10.98 1.09 Allowed 'General case' 0 C--O 1.28 2.677 1 CA-C-O 111.635 -4.031 . . . . 23.4 112.063 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 17.7 mtt -132.79 156.86 46.33 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 126.348 2.28 . . . . 18.04 108.957 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -144.19 158.65 43.61 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 102.057 -3.312 . . . . 16.45 102.057 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 182' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.7 OUTLIER -124.74 150.98 45.66 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 103.245 -2.872 . . . . 22.42 103.245 -177.839 91.115 -85.551 -81.336 105.156 1.992 107.71 -66.179 -63.54 3 3 . 1 . 001 ecloud build full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -149.49 147.51 28.3 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 109.996 -3.274 . . . . 24.37 109.744 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 184' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' H' ' 464' ' ' HOH . . . 152.54 171.16 19.79 Favored Glycine 0 N--CA 1.433 -1.565 1 C-N-CA 131.619 4.438 . . . . 19.5 114.227 179.316 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 184' A TYR . . . . . 0.707 ' O ' ' O ' ' H' ' 503' ' ' HOH . 96.3 m-85 -85.45 153.65 22.35 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.058 -1.26 . . . . 29.73 111.88 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 185' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' H' ' 186' B GLU . 4.8 mmtp -87.71 144.62 35.47 Favored Pre-proline 0 C--N 1.306 -1.304 0 O-C-N 117.352 -3.342 . . . . 40.46 106.454 175.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -63.67 -20.85 69.75 Favored 'Trans proline' 0 N--CA 1.484 0.954 0 N-CA-C 105.363 -2.591 . . . . 42.54 105.363 -170.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 186' A ASP . . . . . . . . . . . . 0.28 0.2 OUTLIER -68.12 -42.1 80.74 Favored 'General case' 0 N--CA 1.484 1.267 2 O-C-N 131.495 5.497 . . . . 50.0 102.725 -179.011 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 186' B GLU . . . . . 0.409 ' N ' ' O ' ' H' ' 185' ' ' LYS . 66.0 mt-10 -62.47 -34.82 77.57 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 127.496 2.998 . . . . 49.13 116.576 -175.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 85.89 31.64 20.15 Favored Glycine 0 C--N 1.28 -2.583 1 O-C-N 114.133 -5.354 . . . . 42.33 110.208 161.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.62 142.1 29.89 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 126.985 2.227 . . . . 43.09 105.384 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 187' ' ' ARG . . . . . 0.414 ' HD3' ' OD2' ' H' ' 221' ' ' ASP . 0.0 OUTLIER -135.26 -162.43 1.26 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 117.772 -3.08 . . . . 31.57 113.464 179.616 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 188' ' ' GLY . . . . . 1.006 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 125.13 152.41 8.26 Favored Glycine 1 C--N 1.404 4.336 4 C-N-CA 111.783 -5.008 . . . . 20.36 100.59 -177.788 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 189' ' ' ASP . . . . . 0.472 ' OD1' ' NH1' ' J' ' 4' ' ' OAR . 50.0 t0 -178.05 160.11 1.39 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 102.904 -2.999 . . . . 27.58 102.904 -177.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.21 -173.33 1.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 103.056 -2.942 . . . . 23.58 103.056 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 191' ' ' CYS . . . . . 0.815 ' O ' ' HB2' ' H' ' 194' ' ' ASP . 10.5 t -167.94 170.67 10.4 Favored 'General case' 0 N--CA 1.483 1.221 1 N-CA-C 99.237 -4.357 . . . . 28.77 99.237 177.282 -164.27 42.833 84.784 100.104 2.013 99.268 178.438 -38.835 3 3 . 1 . 001 ecloud build full ' H' H ' 192' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' H' ' 191' ' ' CYS 0.513 0.0 OUTLIER -37.9 154.53 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 104.455 -2.424 . . . . 45.51 104.455 171.972 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 80.44 -25.15 3.36 Favored Glycine 0 C--O 1.262 1.865 0 C-N-CA 130.23 3.776 . . . . 24.56 112.735 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 194' ' ' ASP . . . . . 0.815 ' HB2' ' O ' ' H' ' 191' ' ' CYS . 41.5 m-20 -76.05 -31.99 59.09 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 129.714 3.206 . . . . 29.35 112.223 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 195' ' ' SER . . . . . 1.127 ' CB ' ' HC2' ' J' ' 4' ' ' OAR . 0.1 OUTLIER -41.02 147.35 0.13 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.568 -1.957 . . . . 28.11 114.651 -178.162 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.3 -7.96 80.9 Favored Glycine 0 C--O 1.251 1.214 0 CA-C-O 125.898 2.943 . . . . 18.77 110.011 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -77.09 176.41 53.28 Favored Glycine 0 C--N 1.348 1.243 1 O-C-N 114.611 -5.053 . . . . 20.77 105.536 -173.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . 0.279 2.1 Cg_endo -93.77 145.34 2.02 Favored 'Trans proline' 0 C--O 1.267 1.953 0 CA-C-N 113.411 -1.394 . . . . 19.65 113.376 176.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 199' ' ' PHE . . . . . 0.516 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 10.9 t80 -111.19 123.1 49.52 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 100.436 -3.913 . . . . 14.42 100.436 168.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.34 153.43 19.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 2 O-C-N 112.709 -6.245 . . . . 20.59 110.326 -170.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 201' ' ' MET . . . . . 1.327 ' CE ' ' HG3' ' H' ' 210' ' ' MET . 37.0 mtm -129.47 154.07 47.34 Favored 'General case' 0 C--O 1.268 2.071 0 CA-C-N 108.964 -3.743 . . . . 20.72 105.796 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 202' ' ' LYS . . . . . 0.697 ' HE3' ' OE2' ' L' ' 8' ' ' GLU . 10.2 tttm -101.06 119.9 39.42 Favored 'General case' 0 N--CA 1.491 1.577 1 O-C-N 129.679 4.362 . . . . 24.48 109.201 177.092 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 203' ' ' SER . . . . . 0.491 ' HB3' ' OD1' ' H' ' 204' B ASN . 30.9 t -67.19 131.7 93.53 Favored Pre-proline 0 C--O 1.274 2.364 0 O-C-N 125.996 2.06 . . . . 17.74 113.022 175.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 204' ' ' PRO . . . . . 0.415 ' HG3' ' HD2' ' L' ' 14' J TYR . 1.1 Cg_endo -79.39 -6.85 14.83 Favored 'Trans proline' 0 C--O 1.267 1.934 0 CA-C-N 111.72 -1.921 . . . . 20.08 110.68 175.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 204' A PHE . . . . . . . . . . . . . 34.1 m-85 -86.77 -49.61 7.33 Favored 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 123.518 0.727 . . . . 25.62 111.293 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 204' B ASN . . . . . 0.517 ' OD1' ' C ' ' H' ' 204' B ASN . 45.0 p-10 -121.09 14.93 11.49 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-N 112.441 -2.163 . . . . 23.38 116.011 179.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 205' ' ' ASN . . . . . 0.515 ' O ' ' HE2' ' H' ' 202' ' ' LYS . 0.8 OUTLIER 57.37 8.51 0.61 Allowed 'General case' 0 C--O 1.255 1.39 0 N-CA-C 117.947 2.573 . . . . 34.84 117.947 175.847 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 24.1 mtt-85 -83.35 153.32 24.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 128.147 2.579 . . . . 30.49 115.492 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 207' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' H' ' 202' ' ' LYS . 94.1 m95 -95.53 124.71 39.69 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 116.408 -1.758 . . . . 19.15 112.986 177.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -113.94 142.96 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 119.776 1.171 . . . . 24.72 112.118 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 209' ' ' GLN . . . . . 0.41 ' HB2' HG11 ' H' ' 121' ' ' VAL . 61.0 tt0 -94.16 109.95 21.71 Favored 'General case' 0 C--O 1.273 2.337 0 CA-C-N 124.061 3.118 . . . . 17.57 107.604 172.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 210' ' ' MET . . . . . 1.327 ' HG3' ' CE ' ' H' ' 201' ' ' MET . 6.6 mmt -81.98 -38.92 24.39 Favored 'General case' 0 C--O 1.28 2.703 0 CA-C-O 124.88 2.276 . . . . 28.19 116.077 173.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -130.87 153.69 20.41 Favored Glycine 0 N--CA 1.497 2.75 0 O-C-N 117.87 -3.019 . . . . 18.53 118.811 -174.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 212' ' ' ILE . . . . . 0.45 HD12 HD12 ' H' ' 103' ' ' ILE . 43.4 mt -112.73 129.24 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.317 0 O-C-N 118.79 -2.594 . . . . 19.83 107.568 171.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 20.5 t -57.89 110.24 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.391 1 O-C-N 114.919 -4.863 . . . . 21.52 107.99 -177.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 214' ' ' SER . . . . . 0.573 ' OG ' ' OD2' ' H' ' 102' ' ' ASP . 0.8 OUTLIER -109.63 -69.67 0.85 Allowed 'General case' 0 C--O 1.272 2.245 0 N-CA-C 116.224 1.935 . . . . 19.11 116.224 -173.689 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 215' ' ' TRP . . . . . 0.486 ' CH2' HD11 ' H' ' 176' ' ' ILE . 37.3 p-90 -156.53 165.92 34.89 Favored 'General case' 0 CA--C 1.478 -1.808 0 C-N-CA 115.344 -2.542 . . . . 25.12 106.797 -177.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 216' ' ' GLY . . . . . 0.602 ' O ' ' N ' ' J' ' 2' ' ' LEU . . . -164.93 151.64 20.73 Favored Glycine 0 CA--C 1.547 2.072 0 CA-C-O 114.552 -3.36 . . . . 20.96 104.964 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 217' ' ' GLU . . . . . 0.787 ' HB2' ' HD3' ' H' ' 224' ' ' LYS . 0.2 OUTLIER -75.46 100.39 4.48 Favored 'General case' 1 C--N 1.493 6.847 0 O-C-N 128.77 3.277 . . . . 33.27 110.46 169.638 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 219' ' ' GLY . . . . . 0.796 ' N ' ' O4 ' ' J' ' 1' ' ' 34H . . . 54.56 154.25 0.01 OUTLIER Glycine 0 C--N 1.27 -3.096 0 N-CA-C 109.864 -1.294 . . . . 28.53 109.864 -175.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -84.21 132.15 34.68 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 127.156 3.36 . . . . 30.29 114.823 176.474 -38.835 178.438 84.784 99.268 2.013 100.104 42.833 -164.27 1 1 . 1 . 001 ecloud build full ' H' H ' 221' ' ' ASP . . . . . 0.414 ' OD2' ' HD3' ' H' ' 187' ' ' ARG . 23.2 t0 50.94 38.17 19.49 Favored 'General case' 0 C--O 1.272 2.284 0 O-C-N 116.449 -3.907 . . . . 33.39 112.815 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 221' A ARG . . . . . 0.683 HH22 ' H5 ' ' J' ' 1' ' ' 34H . 4.6 mmt85 -82.41 136.27 34.99 Favored 'General case' 0 C--O 1.264 1.832 0 O-C-N 117.059 -3.526 . . . . 41.02 106.103 173.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.77 131.98 30.95 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 118.179 -2.826 . . . . 49.44 111.388 172.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 76.98 4.11 82.39 Favored Glycine 0 C--O 1.248 1.003 0 O-C-N 120.226 -1.546 . . . . 34.41 115.315 176.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 224' ' ' LYS . . . . . 0.787 ' HD3' ' HB2' ' H' ' 217' ' ' GLU . 17.0 mttp -114.1 156.27 24.48 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 107.306 -1.368 . . . . 35.37 107.306 174.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -132.25 150.41 52.16 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 126.927 2.091 . . . . 31.16 113.885 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 226' ' ' GLY . . . . . 0.648 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -76.91 150.61 37.89 Favored Glycine 0 CA--C 1.489 -1.54 0 N-CA-C 104.076 -3.61 . . . . 22.73 104.076 178.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -115.82 142.71 46.4 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 108.995 -3.603 . . . . 18.47 110.886 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 228' ' ' TYR . . . . . 0.423 ' HB3' ' O ' ' H' ' 212' ' ' ILE . 44.2 m-85 -139.29 143.09 37.75 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 112.234 -3.746 . . . . 20.57 113.612 -175.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.11 143.21 57.99 Favored 'General case' 0 C--O 1.265 1.874 0 O-C-N 126.82 2.575 . . . . 16.81 110.19 173.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -89.91 90.26 8.09 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.865 1.666 . . . . 27.67 109.264 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 231' ' ' VAL . . . . . 0.51 ' HB ' ' O ' ' H' ' 210' ' ' MET . 4.2 t -54.12 -46.29 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 114.238 -2.791 . . . . 19.32 108.814 -172.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 232' ' ' PHE . . . . . 0.477 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 69.1 t80 -59.65 -45.88 90.68 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 116.087 -2.245 . . . . 31.76 113.899 178.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -55.9 -21.52 20.84 Favored 'General case' 0 C--O 1.248 1.003 1 O-C-N 114.616 -5.053 . . . . 34.63 107.884 -176.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 234' ' ' LEU . . . . . 0.874 HD12 HG21 ' H' ' 103' ' ' ILE . 1.5 mt -107.69 3.21 24.42 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 115.714 -2.395 . . . . 26.58 114.49 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 235' ' ' LYS . . . . . 0.838 ' NZ ' ' O ' ' H' ' 124' ' ' PRO . 36.2 tttt -55.59 -39.53 70.86 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-N 117.717 0.235 . . . . 35.19 110.545 -175.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -36.03 82.26 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 114.441 -2.904 . . . . 50.0 110.634 -175.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 52.2 t90 -67.29 -49.29 64.85 Favored 'General case' 0 CA--C 1.507 -0.694 0 O-C-N 118.295 -2.753 . . . . 31.93 104.424 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 238' ' ' ILE . . . . . 0.42 HD11 HD11 ' H' ' 103' ' ' ILE . 89.3 mt -59.08 -34.94 54.73 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 O-C-N 127.523 3.014 . . . . 30.77 110.566 179.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 239' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' H' ' 235' ' ' LYS . 0.0 OUTLIER -66.3 -47.15 74.53 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 124.438 1.086 . . . . 50.0 108.465 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 240' ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' H' ' 244' ' ' GLN . 0.0 OUTLIER -53.53 -63.45 1.14 Allowed 'General case' 0 C--O 1.262 1.741 0 CA-C-O 114.614 -2.613 . . . . 50.0 115.177 177.47 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 241' ' ' VAL . . . . . 0.563 ' HB ' ' CE1' ' H' ' 245' ' ' PHE . 0.6 OUTLIER -58.9 -33.29 49.32 Favored 'Isoleucine or valine' 0 C--O 1.267 1.99 0 CA-C-N 124.6 3.364 . . . . 41.31 113.473 -176.514 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 242' ' ' ILE . . . . . 0.833 ' O ' ' HA3' ' H' ' 246' ' ' GLY . 47.2 mt -67.63 -44.79 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 117.285 -1.766 . . . . 43.17 109.19 -178.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 -44.97 94.96 Favored 'General case' 0 N--CA 1.491 1.611 1 CA-C-O 130.606 5.003 . . . . 50.0 107.069 179.656 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 244' ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' H' ' 240' ' ' LYS 0.259 7.4 mm-40 -55.52 -43.88 76.14 Favored 'General case' 0 C--N 1.314 -0.958 1 CA-C-N 105.393 -5.367 . . . . 50.0 112.204 -175.46 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' H' H ' 245' ' ' PHE . . . . . 0.726 ' CE1' ' CE2' ' H' ' 89' ' ' TYR . 0.3 OUTLIER -161.02 31.0 0.14 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 114.808 -2.757 . . . . 50.0 108.388 -179.733 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 246' ' ' GLY . . . . . 0.833 ' HA3' ' O ' ' H' ' 242' ' ' ILE . . . -72.66 -160.09 5.13 Favored Glycine 0 C--O 1.259 1.705 1 N-CA-C 126.405 5.322 . . . . 50.0 126.405 -178.313 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 247' ' ' GLU . . . . . 1.093 ' CG ' ' HG3' ' H' ' 50' ' ' ARG 0.268 2.2 mm-40 . . . . . 0 C--O 1.277 2.518 0 CA-C-N 109.323 -3.439 . . . . 50.0 107.93 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 355' ' ' ASP . . . . . 0.676 ' HB3' ' O ' ' I' ' 553' ' ' HOH . 47.0 t0 . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 128.286 3.898 . . . . 50.0 105.321 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 356' ' ' PHE . . . . . 0.463 ' HA ' ' HB ' ' H' ' 74' ' ' THR . 45.0 m-85 -76.28 115.25 15.83 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 109.454 -3.521 . . . . 43.98 111.393 178.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 357' ' ' GLU . . . . . 0.897 ' OE1' ' HD3' ' H' ' 75' ' ' ARG . 40.4 tt0 -56.04 158.92 3.6 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 125.481 1.738 . . . . 45.78 106.418 174.768 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 358' ' ' GLU . . . . . 0.652 ' N ' ' HG2' ' I' ' 357' ' ' GLU . 0.0 OUTLIER -72.32 145.36 47.86 Favored 'General case' 0 C--O 1.265 1.888 0 N-CA-C 114.516 1.302 . . . . 50.0 114.516 -172.161 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 359' ' ' ILE . . . . . 0.529 HG23 ' NE2' ' H' ' 38' ' ' GLN . 0.1 OUTLIER -107.52 149.97 39.52 Favored Pre-proline 0 C--O 1.242 0.707 0 CA-C-O 111.969 -3.872 . . . . 50.0 107.728 177.521 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 360' ' ' PRO . . . . . 0.872 ' HG2' ' CD2' ' I' ' 363' ' ' TYS . 9.4 Cg_endo -68.4 126.23 13.94 Favored 'Trans proline' 0 N--CA 1.441 -1.574 2 O-C-N 132.075 5.776 . . . . 50.0 115.877 178.355 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' I' I ' 361' ' ' GLU . . . . . 0.601 ' C ' ' N ' ' I' ' 363' ' ' TYS . . . -52.09 -25.67 9.3 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 110.523 -3.035 . . . . 50.0 110.842 -175.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 362' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.73 -18.39 8.13 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 102.112 -3.292 . . . . 50.0 102.112 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 363' ' ' TYS . . . . . 0.872 ' CD2' ' HG2' ' I' ' 360' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 364' ' ' LEU . . . . . 0.418 HD11 ' OE1' ' H' ' 38' ' ' GLN . 20.8 mt . . . . . 0 C--O 1.27 2.139 0 CA-C-O 114.94 -2.457 . . . . 50.0 106.646 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 1' ' ' 34H . . . . . 0.796 ' O4 ' ' N ' ' H' ' 219' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 2' ' ' LEU . . . . . 0.732 HD21 ' OE1' ' H' ' 217' ' ' GLU 0.332 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 N-CA-C 100.99 -3.707 . . . . 35.33 100.99 . . . . . . . . . 3 3 . 1 . 001 ecloud build full ' J' J ' 3' ' ' PRJ . . . . . 0.816 ' H13' ' CZ2' ' H' ' 60' D TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 4' ' ' OAR . . . . . 1.127 ' HC2' ' CB ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 626' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 453' ' ' HOH . . . . . 0.761 ' O ' ' N ' ' H' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 460' ' ' HOH . . . . . 0.438 ' O ' ' O ' ' H' ' 64' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 464' ' ' HOH . . . . . 0.49 ' O ' ' O ' ' H' ' 184' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 468' ' ' HOH . . . . . 0.601 ' O ' ' HE3' ' H' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 500' ' ' HOH . . . . . 0.662 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 503' ' ' HOH . . . . . 0.707 ' O ' ' O ' ' H' ' 184' A TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 521' ' ' HOH . . . . . 0.654 ' O ' HG22 ' H' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 529' ' ' HOH . . . . . 0.706 ' O ' ' CA ' ' L' ' 1' D GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 550' ' ' HOH . . . . . 0.465 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 615' ' ' HOH . . . . . 0.691 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 553' ' ' HOH . . . . . 0.676 ' O ' ' HB3' ' I' ' 355' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 462' ' ' HOH . . . . . 0.726 ' O ' ' HG3' ' J' ' 4' ' ' OAR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' H THR . . . . . 0.974 ' O ' HD12 ' H' ' 123' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.264 1.839 0 N-CA-C 100.25 -3.982 . . . . 50.0 100.25 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' G PHE . . . . . 0.832 ' CD2' ' N ' ' L' ' 1' F GLY 0.26 22.8 p90 -67.84 -141.19 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 128.064 3.792 . . . . 50.0 114.506 176.864 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 1' F GLY . . . . . 0.832 ' N ' ' CD2' ' L' ' 1' G PHE . . . -22.86 106.88 0.01 OUTLIER Glycine 0 N--CA 1.477 1.418 1 CA-C-O 112.712 -4.382 . . . . 50.0 107.443 179.916 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 1' E SER . . . . . 1.142 ' HA ' ' O ' ' H' ' 123' ' ' LEU . 4.7 t 33.89 83.5 0.02 OUTLIER 'General case' 0 C--O 1.264 1.861 0 O-C-N 128.811 3.301 . . . . 50.0 112.758 177.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' D GLY . . . . . 0.706 ' CA ' ' O ' ' H' ' 529' ' ' HOH . . . 29.63 -143.78 0.01 OUTLIER Glycine 0 C--O 1.259 1.68 0 O-C-N 128.557 3.661 . . . . 50.0 111.374 -178.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' C GLU . . . . . 1.455 ' CG ' ' H ' ' L' ' 1' B ALA . 0.5 OUTLIER -71.21 -148.66 0.02 OUTLIER 'General case' 0 C--O 1.26 1.655 1 N-CA-C 123.761 4.726 . . . . 50.0 123.761 -174.516 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' L' L ' 1' B ALA . . . . . 1.455 ' H ' ' CG ' ' L' ' 1' C GLU . . . -101.5 -60.15 1.58 Allowed 'General case' 0 C--O 1.242 0.677 0 C-N-CA 129.453 3.101 . . . . 48.03 107.538 -175.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' A ASP . . . . . 0.731 ' OD2' ' HE3' ' L' ' 9' ' ' LYS . 17.0 t0 -103.91 21.92 15.47 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 110.839 -2.891 . . . . 50.0 109.584 175.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' CYS . . . . . 0.909 ' HB3' ' HB3' ' L' ' 1' C GLU . 25.2 p -55.2 144.11 25.47 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.482 -1.287 . . . . 29.4 113.49 -173.955 67.354 79.693 96.047 102.158 2.006 104.621 -52.627 -68.329 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.46 7.9 42.54 Favored Glycine 0 C--O 1.265 2.06 1 N-CA-C 127.98 5.952 . . . . 19.21 127.98 174.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . 0.608 ' O ' ' CD2' ' H' ' 119' ' ' HIS . 54.6 mt -111.78 102.64 10.91 Favored 'General case' 0 C--O 1.256 1.409 0 N-CA-C 102.159 -3.275 . . . . 17.79 102.159 178.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' ARG . . . . . 0.64 ' NH2' ' OE2' ' L' ' 14' C GLU . 6.3 mtm180 -75.94 133.36 72.78 Favored Pre-proline 0 C--O 1.263 1.814 1 CA-C-N 106.936 -4.666 . . . . 19.0 110.455 -177.123 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.61 -33.23 96.29 Favored 'Trans proline' 0 CA--C 1.479 -2.245 0 O-C-N 128.09 3.679 . . . . 26.53 112.775 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.2 mp -99.85 5.63 45.41 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 119.896 -1.752 . . . . 26.69 115.246 -174.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -134.21 -74.75 0.47 Allowed 'General case' 0 C--N 1.316 -0.861 0 O-C-N 120.865 -1.147 . . . . 26.9 111.077 178.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' GLU . . . . . 0.697 ' OE2' ' HE3' ' H' ' 202' ' ' LYS . 10.1 mp0 -56.74 -58.29 8.74 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 115.376 -2.25 . . . . 26.47 110.994 -179.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.731 ' HE3' ' OD2' ' L' ' 1' A ASP . 6.4 mttt -53.84 -14.19 0.91 Allowed 'General case' 0 C--N 1.297 -1.704 0 O-C-N 128.232 3.457 . . . . 28.06 114.994 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LYS . . . . . . . . . . . . 0.258 82.1 mttt -125.54 -2.72 7.36 Favored 'General case' 0 C--O 1.211 -0.937 0 CA-C-O 114.556 -2.64 . . . . 35.51 108.381 -176.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' SER . . . . . . . . . . . . 0.368 10.1 t 66.72 42.7 2.59 Favored 'General case' 0 C--O 1.267 1.995 1 O-C-N 134.443 7.34 . . . . 26.32 113.028 178.954 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' LEU . . . . . . . . . . . . . 43.1 mt -113.84 142.11 46.5 Favored 'General case' 0 C--N 1.362 1.13 0 CA-C-O 112.032 -3.842 . . . . 27.34 108.673 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' GLU . . . . . . . . . . . . 0.39 6.5 mt-10 -99.64 148.86 23.88 Favored 'General case' 0 C--O 1.251 1.178 1 CA-C-O 110.668 -4.492 . . . . 46.84 111.893 176.816 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' C ' ' L' ' 14' ' ' ASP . 5.6 p30 -84.46 163.51 19.4 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 127.045 2.716 . . . . 27.27 105.297 175.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' A LYS . . . . . 0.943 ' HG3' ' OE2' ' H' ' 23' ' ' GLU . 0.0 OUTLIER -60.72 -17.43 48.34 Favored 'General case' 0 C--O 1.263 1.804 1 CA-C-O 111.38 -4.152 . . . . 41.68 113.891 -171.338 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' L' L ' 14' B THR . . . . . 0.648 ' O ' ' HD3' ' L' ' 14' D ARG 0.251 77.7 p -124.43 -11.31 7.39 Favored 'General case' 0 N--CA 1.518 2.97 0 C-N-CA 114.394 -2.922 . . . . 31.81 115.584 -179.257 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' C GLU . . . . . 0.64 ' OE2' ' NH2' ' L' ' 4' ' ' ARG 0.316 31.3 mt-10 -34.44 -47.31 0.3 Allowed 'General case' 0 N--CA 1.474 0.773 0 O-C-N 124.206 0.941 . . . . 33.79 111.287 176.421 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' D ARG . . . . . 1.127 ' HD3' ' N ' ' L' ' 14' E GLU . 0.0 OUTLIER -37.74 -51.18 1.25 Allowed 'General case' 0 C--N 1.395 2.577 0 C-N-CA 114.918 -2.713 . . . . 50.0 110.075 179.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' E GLU . . . . . 1.127 ' N ' ' HD3' ' L' ' 14' D ARG . 10.8 tt0 -44.88 -53.47 7.51 Favored 'General case' 0 C--N 1.382 1.983 0 CA-C-N 111.32 -2.673 . . . . 40.66 110.455 -171.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' F LEU . . . . . 0.607 HD12 ' N ' ' L' ' 14' F LEU . 5.3 mp -50.39 -63.57 1.08 Allowed 'General case' 0 C--O 1.251 1.155 0 CA-C-N 112.371 -2.195 . . . . 29.29 109.724 177.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' G LEU . . . . . 0.793 ' O ' ' HA ' ' L' ' 14' L ASP . 3.6 mm? -50.56 -45.54 57.1 Favored 'General case' 0 CA--C 1.5 -0.976 0 O-C-N 124.901 1.376 . . . . 28.69 113.724 -178.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' H GLU . . . . . 0.737 ' HG3' ' O ' ' L' ' 14' D ARG . 92.1 mt-10 -60.63 -16.41 38.39 Favored 'General case' 0 C--N 1.296 -1.733 1 CA-C-O 110.98 -4.343 . . . . 50.0 115.732 -175.77 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 14' I SER . . . . . 0.709 ' C ' ' N ' ' L' ' 14' K ILE . 59.6 p -94.87 -29.64 14.6 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 127.931 3.27 . . . . 33.11 113.23 -176.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' J TYR . . . . . 0.641 ' C ' HG13 ' L' ' 14' K ILE . 4.9 m-30 -76.29 39.46 0.2 Allowed 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 102.798 -3.038 . . . . 39.92 102.798 179.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' K ILE . . . . . 0.709 ' N ' ' C ' ' L' ' 14' I SER . 0.1 OUTLIER 29.06 48.63 0.12 Allowed 'Isoleucine or valine' 1 C--N 1.124 -9.229 2 CA-C-N 102.217 -6.81 . . . . 49.83 109.009 -158.533 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' L' L ' 14' L ASP . . . . . 1.368 ' C ' ' N ' ' L' ' 14' M GLY . 7.6 m-20 87.08 163.5 0.08 Allowed 'General case' 0 N--CA 1.478 0.954 0 O-C-N 129.044 3.965 . . . . 50.0 109.936 -179.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 14' M GLY . . . . . 1.368 ' N ' ' C ' ' L' ' 14' L ASP . . . -70.36 -156.89 1.86 Allowed Glycine 1 C--N 1.743 23.184 2 O-C-N 97.449 -15.782 . . . . 50.0 121.084 -165.201 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' L' L ' 15' ' ' ARG . . . . . 0.492 ' OXT' ' O ' ' L' ' 14' M GLY . . . . . . . . 0 C--O 1.282 2.811 0 CA-C-O 114.415 -2.707 . . . . 50.0 108.372 179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' ILE . . . . . 0.425 ' N ' ' OD2' ' H' ' 194' ' ' ASP . 33.2 mm . . . . . 0 C--O 1.261 1.678 0 N-CA-C 103.568 -2.753 . . . . 21.21 103.568 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' VAL . . . . . 1.006 ' O ' ' HA2' ' H' ' 188' ' ' GLY . 74.1 t -108.93 130.46 61.79 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-O 128.339 3.924 . . . . 27.37 110.143 178.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' GLU . . . . . 0.443 ' HB2' ' O ' ' H' ' 17' ' ' VAL . 4.2 mm-40 60.61 49.12 6.72 Favored 'General case' 0 C--N 1.312 -1.023 1 O-C-N 115.341 -4.599 . . . . 41.48 113.615 -179.137 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLY . . . . . . . . . . . . . . . -132.1 -175.67 14.08 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-O 116.127 -2.485 . . . . 32.73 108.191 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.92 179.98 3.9 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 118.992 1.396 . . . . 38.32 111.351 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' ASP . . . . . 0.949 ' HB3' ' CG1' ' H' ' 154' ' ' VAL . 26.5 m-20 -82.95 130.43 35.14 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 126.961 2.663 . . . . 35.52 105.51 177.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' ALA . . . . . 0.84 ' HB2' ' CG1' ' H' ' 157' ' ' VAL . . . -60.33 147.74 39.44 Favored 'General case' 0 C--N 1.279 -2.474 0 O-C-N 128.493 3.621 . . . . 29.58 109.974 178.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' GLU . . . . . 0.943 ' OE2' ' HG3' ' L' ' 14' A LYS . 22.4 mt-10 -70.55 159.1 34.94 Favored 'General case' 0 C--O 1.262 1.745 0 CA-C-N 121.897 2.135 . . . . 32.7 110.423 170.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 mm -65.37 139.11 21.9 Favored 'Isoleucine or valine' 0 C--O 1.259 1.587 0 N-CA-C 103.164 -2.902 . . . . 21.89 103.164 179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 25' ' ' GLY . . . . . . . . . . . . . . . 50.21 34.19 24.57 Favored Glycine 0 N--CA 1.421 -2.304 1 C-N-CA 137.641 7.305 . . . . 18.4 112.75 -174.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 26' ' ' MET . . . . . . . . . . . . . 5.0 ttt -79.84 -21.41 44.2 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 127.457 2.303 . . . . 24.71 111.624 -177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 27' ' ' SER . . . . . . . . . . . . 0.253 0.2 OUTLIER -137.61 65.02 46.44 Favored Pre-proline 0 C--N 1.317 -0.815 0 C-N-CA 127.632 2.373 . . . . 26.28 111.763 -179.392 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 28' ' ' PRO . . . . . 0.516 ' CG ' ' HG2' ' L' ' 4' ' ' ARG . 2.6 Cg_endo -60.81 -12.23 21.06 Favored 'Trans proline' 0 C--O 1.27 2.093 0 C-N-CA 122.095 1.864 . . . . 17.65 113.799 -177.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 29' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -99.56 -2.32 36.03 Favored 'General case' 0 C--O 1.269 2.095 0 CA-C-O 116.562 -1.685 . . . . 18.05 113.307 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 30' ' ' GLN . . . . . 0.608 ' OE1' ' OG1' ' H' ' 139' ' ' THR . 64.3 tp60 -72.31 121.38 19.36 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 129.103 2.961 . . . . 19.85 107.11 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 31' ' ' VAL . . . . . . . . . . . . . 96.8 t -120.96 139.64 47.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 O-C-N 126.508 2.38 . . . . 22.52 110.246 -176.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 32' ' ' MET . . . . . 0.729 ' HG3' HD13 ' H' ' 40' ' ' LEU . 47.2 ttm -103.35 118.79 37.57 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 113.87 -2.967 . . . . 24.5 105.995 -177.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 33' ' ' LEU . . . . . . . . . . . . 0.399 0.0 OUTLIER -84.7 119.93 25.82 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 104.241 -2.503 . . . . 34.4 104.241 173.436 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 34' ' ' PHE . . . . . 0.453 ' HE2' ' HG2' ' H' ' 38' ' ' GLN . 47.8 t80 -125.38 130.78 52.59 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 116.02 -0.536 . . . . 31.62 111.461 -171.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 35' ' ' ARG . . . . . 0.79 ' O ' ' HA ' ' H' ' 38' ' ' GLN . 29.1 ttt180 -78.64 128.78 33.96 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 125.154 2.407 . . . . 41.68 109.201 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' ' ' LYS . . . . . 0.785 ' O ' ' HG3' ' H' ' 38' ' ' GLN . 10.4 mtpt -63.8 -41.1 97.98 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 115.704 -2.398 . . . . 41.82 115.194 178.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 36' A SER . . . . . . . . . . . . . 0.1 OUTLIER -152.21 108.03 2.81 Favored Pre-proline 0 C--O 1.275 2.436 0 CA-C-O 116.204 -1.855 . . . . 50.0 115.568 -173.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 37' ' ' PRO . . . . . 0.711 ' O ' ' HG2' ' H' ' 39' ' ' GLU . 3.6 Cg_endo -64.05 135.3 20.42 Favored 'Cis proline' 0 N--CA 1.445 -1.379 0 CA-C-N 121.236 1.477 . . . . 44.65 108.819 -2.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 38' ' ' GLN . . . . . 0.79 ' HA ' ' O ' ' H' ' 35' ' ' ARG . 5.4 mt-30 -63.51 104.19 0.61 Allowed 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 112.118 -3.801 . . . . 47.38 106.971 -178.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 39' ' ' GLU . . . . . 0.711 ' HG2' ' O ' ' H' ' 37' ' ' PRO . 5.7 pt-20 -154.4 150.88 28.36 Favored 'General case' 0 C--N 1.322 -0.625 1 O-C-N 133.189 6.556 . . . . 47.29 116.242 -178.432 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 40' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' H' ' 32' ' ' MET . 41.1 tp -67.04 118.76 10.93 Favored 'General case' 0 N--CA 1.433 -1.294 1 CA-C-O 111.002 -4.332 . . . . 35.35 107.713 178.788 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 41' ' ' LEU . . . . . 0.456 HD13 ' CE2' ' H' ' 60' H PHE . 11.9 mt -89.23 -52.46 5.04 Favored 'General case' 0 C--N 1.312 -1.028 1 O-C-N 129.683 4.364 . . . . 35.94 109.1 176.835 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 42' ' ' CYS . . . . . 0.511 ' HB3' ' O ' ' H' ' 195' ' ' SER . 93.9 m -163.46 -176.8 4.91 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 125.336 1.454 . . . . 24.3 111.662 -173.276 -65.072 -170.382 -101.332 96.315 2.203 99.781 -84.356 -69.737 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 43' ' ' GLY . . . . . 0.507 ' O ' ' HB2' ' H' ' 44' ' ' ALA . . . -96.92 -164.23 32.56 Favored Glycine 0 C--O 1.252 1.242 0 N-CA-C 107.41 -2.276 . . . . 17.59 107.41 177.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 44' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' H' ' 43' ' ' GLY . . . 169.17 164.93 0.05 OUTLIER 'General case' 0 C--O 1.272 2.253 0 O-C-N 118.764 -2.61 . . . . 16.93 106.102 -174.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 45' ' ' SER . . . . . . . . . . . . . 60.3 p -131.05 145.01 51.87 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 117.044 -1.862 . . . . 24.36 108.467 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 46' ' ' LEU . . . . . 0.538 HD22 ' O ' ' H' ' 48' ' ' SER . 0.0 OUTLIER -89.45 125.01 35.0 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-O 113.789 -3.005 . . . . 20.65 103.685 -178.752 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 47' ' ' ILE . . . . . . . . . . . . 0.266 42.4 pt -119.12 6.42 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 1 O-C-N 130.03 4.581 . . . . 25.88 112.941 -178.318 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 48' ' ' SER . . . . . 0.538 ' O ' HD22 ' H' ' 46' ' ' LEU . 1.0 OUTLIER -179.01 -174.88 0.36 Allowed 'General case' 0 C--O 1.266 1.961 1 CA-C-O 111.453 -4.118 . . . . 29.07 104.284 176.044 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 49' ' ' ASP . . . . . 0.854 ' O ' HG23 ' H' ' 112' ' ' VAL . 21.2 p-10 -82.98 -7.96 59.61 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 124.136 3.153 . . . . 36.28 113.149 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 50' ' ' ARG . . . . . 1.093 ' HG3' ' CG ' ' H' ' 247' ' ' GLU . 7.8 mmm180 -114.98 -11.62 12.12 Favored 'General case' 0 C--O 1.261 1.703 0 N-CA-C 115.221 1.563 . . . . 40.11 115.221 179.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 51' ' ' TRP . . . . . 0.542 ' CZ3' ' HB3' ' H' ' 107' ' ' LYS . 90.0 m95 -121.4 140.48 52.09 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 125.703 2.668 . . . . 33.38 113.607 -177.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 52' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.48 141.85 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 CA-C-N 110.912 -2.858 . . . . 22.4 109.332 176.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 53' ' ' LEU . . . . . 0.407 HD11 HG13 ' H' ' 103' ' ' ILE . 14.0 tp -120.6 135.88 54.97 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 121.176 1.807 . . . . 20.64 109.834 179.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 54' ' ' THR . . . . . . . . . . . . . 5.2 t -150.66 175.27 12.1 Favored 'General case' 0 N--CA 1.491 1.621 0 CA-C-N 112.398 -2.183 . . . . 25.33 112.449 -177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.39 143.47 48.54 Favored 'General case' 0 N--CA 1.52 3.051 1 CA-C-O 111.697 -4.001 . . . . 21.07 110.982 -178.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 56' ' ' ALA . . . . . 0.775 ' CB ' HG23 ' H' ' 90' ' ' ILE . . . -66.6 -25.04 66.43 Favored 'General case' 0 N--CA 1.492 1.639 1 CA-C-N 126.583 4.265 . . . . 18.77 110.732 172.619 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 57' ' ' HIS . . . . . 0.439 ' CE1' ' OG ' ' H' ' 195' ' ' SER 0.297 5.6 p-80 -67.45 -19.17 65.33 Favored 'General case' 0 C--O 1.274 2.352 1 O-C-N 115.848 -4.283 . . . . 23.53 110.364 -177.307 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 58' ' ' CYS . . . . . . . . . . . . . 96.7 m -59.94 -25.63 65.33 Favored 'General case' 0 C--O 1.289 3.18 0 CA-C-N 124.836 3.471 . . . . 25.26 114.113 172.289 -69.737 -84.356 -101.332 99.781 2.203 96.315 -170.382 -65.072 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 59' ' ' LEU . . . . . 0.64 HD22 HD13 ' H' ' 88' ' ' ILE . 9.3 mt -104.15 -39.4 6.54 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.437 -2.04 . . . . 26.66 113.84 -175.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' ' ' LEU . . . . . 0.556 HD13 ' OD1' ' H' ' 60' G ASN . 18.9 tp -137.6 125.85 23.15 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.718 3.207 . . . . 28.86 114.491 -174.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' A TYR . . . . . 0.816 ' C ' ' HD2' ' H' ' 60' C PRO . 15.3 t80 -161.19 77.26 2.38 Favored Pre-proline 0 N--CA 1.48 1.056 0 N-CA-C 102.332 -3.21 . . . . 37.73 102.332 -178.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' B PRO . . . . . 0.836 ' N ' ' HD2' ' H' ' 60' C PRO . 3.0 Cg_exo -53.51 -32.43 63.35 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.977 1.785 . . . . 32.16 114.017 -169.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' C PRO . . . . . 0.836 ' HD2' ' N ' ' H' ' 60' B PRO . 6.2 Cg_exo -64.17 -25.96 65.13 Favored 'Trans proline' 0 N--CA 1.425 -2.541 1 C-N-CA 126.214 4.609 . . . . 35.31 116.2 -178.704 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 60' D TRP . . . . . 0.816 ' CZ2' ' H13' ' J' ' 3' ' ' PRJ . 29.9 m0 -112.31 21.44 15.76 Favored 'General case' 0 C--N 1.307 -1.253 2 N-CA-C 95.719 -5.659 . . . . 41.97 95.719 178.133 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 60' E ASP . . . . . . . . . . . . 0.289 10.7 m-20 61.96 13.03 5.28 Favored 'General case' 0 N--CA 1.504 2.239 1 N-CA-C 122.089 4.107 . . . . 41.33 122.089 178.733 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' F LYS . . . . . 0.583 ' HD3' ' CE2' ' H' ' 60' H PHE . 4.1 ttpt -90.34 123.66 34.27 Favored 'General case' 0 C--O 1.253 1.26 0 CA-C-O 128.027 3.775 . . . . 32.69 114.265 178.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' G ASN . . . . . 0.556 ' OD1' HD13 ' H' ' 60' ' ' LEU . 62.9 t30 -150.45 70.72 1.03 Allowed 'General case' 0 C--O 1.253 1.277 0 CA-C-N 109.484 -3.507 . . . . 43.6 113.285 -178.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' H PHE . . . . . 0.583 ' CE2' ' HD3' ' H' ' 60' F LYS . 31.4 m-85 -69.24 129.72 40.62 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 126.497 3.046 . . . . 36.4 113.099 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 60' I THR . . . . . 0.772 HG23 ' CG ' ' H' ' 63' ' ' ASP . 0.6 OUTLIER -94.68 166.27 12.09 Favored 'General case' 0 C--N 1.291 -1.946 0 C-N-CA 131.002 3.721 . . . . 43.48 107.585 174.643 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 61' ' ' GLU . . . . . 0.687 ' OE1' ' HA ' ' H' ' 87' ' ' LYS . 0.0 OUTLIER -57.46 -48.11 80.04 Favored 'General case' 0 C--O 1.259 1.603 0 CA-C-N 112.686 -2.052 . . . . 50.0 116.157 -178.686 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 62' ' ' ASN . . . . . 0.422 ' C ' HD22 ' H' ' 62' ' ' ASN . 0.4 OUTLIER -90.38 29.96 1.2 Allowed 'General case' 0 C--O 1.217 -0.643 0 O-C-N 118.099 -2.876 . . . . 50.0 111.248 178.033 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 63' ' ' ASP . . . . . 0.772 ' CG ' HG23 ' H' ' 60' I THR . 1.0 OUTLIER -98.31 -23.96 15.42 Favored 'General case' 0 C--N 1.284 -2.246 0 O-C-N 127.113 2.758 . . . . 44.56 109.304 178.738 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 64' ' ' LEU . . . . . 0.438 ' O ' ' O ' ' H' ' 460' ' ' HOH 0.33 9.2 mt -120.66 160.29 23.57 Favored 'General case' 0 C--O 1.262 1.713 2 O-C-N 132.506 6.129 . . . . 36.27 123.067 -174.583 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 65' ' ' LEU . . . . . 0.733 HD11 ' CE ' ' H' ' 84' ' ' MET . 0.0 OUTLIER -128.61 157.31 41.63 Favored 'General case' 0 C--N 1.318 -0.778 1 CA-C-O 110.52 -4.562 . . . . 28.98 106.897 169.904 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 66' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -113.07 139.3 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-O 113.251 -3.262 . . . . 26.74 102.462 170.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 67' ' ' ARG . . . . . 0.768 ' HD3' ' HD2' ' H' ' 70' ' ' LYS . 51.2 mtt180 -113.78 121.36 43.82 Favored 'General case' 0 C--O 1.283 2.837 0 CA-C-O 113.316 -3.231 . . . . 37.22 110.45 174.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 68' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.93 142.4 34.15 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.118 0 CA-C-N 122.629 2.468 . . . . 26.98 113.356 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 69' ' ' GLY . . . . . 1.049 ' O ' HD11 ' H' ' 79' ' ' ILE . . . 101.09 6.99 50.95 Favored Glycine 0 C--O 1.258 1.641 1 O-C-N 115.351 -4.593 . . . . 25.84 108.374 178.11 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 70' ' ' LYS . . . . . 0.768 ' HD2' ' HD3' ' H' ' 67' ' ' ARG . 2.2 mtpp -78.73 156.68 28.78 Favored 'General case' 0 C--N 1.353 0.739 0 O-C-N 129.299 3.588 . . . . 24.39 108.171 -176.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 71' ' ' HIS . . . . . 0.492 ' CD2' HG22 ' H' ' 154' ' ' VAL . 76.0 t60 -136.76 -50.62 0.66 Allowed 'General case' 0 N--CA 1.483 1.2 1 CA-C-O 129.531 4.491 . . . . 24.17 102.514 175.859 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 72' ' ' SER . . . . . 0.414 ' O ' ' CE ' ' H' ' 70' ' ' LYS . 5.0 t -73.06 137.83 45.55 Favored 'General case' 0 N--CA 1.486 1.349 1 O-C-N 115.799 -4.313 . . . . 28.12 107.487 177.951 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 73' ' ' ARG . . . . . 0.498 ' CZ ' ' HB3' ' H' ' 151' ' ' GLN . 55.6 ttp85 -63.04 -52.21 63.75 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 128.947 3.904 . . . . 35.3 113.949 176.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 74' ' ' THR . . . . . 0.691 ' O ' ' O ' ' H' ' 615' ' ' HOH . 20.5 p -109.96 -19.3 13.14 Favored 'General case' 0 C--O 1.269 2.082 0 N-CA-C 119.953 3.316 . . . . 30.72 119.953 -176.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ARG . . . . . 0.897 ' HD3' ' OE1' ' I' ' 357' ' ' GLU . 11.7 mmt180 -72.96 151.07 42.0 Favored 'General case' 0 CA--C 1.493 -1.248 0 O-C-N 118.209 -2.807 . . . . 45.43 115.68 178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -90.37 110.27 21.36 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 115.647 -2.12 . . . . 41.19 106.39 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -85.17 81.05 9.0 Favored 'General case' 0 C--O 1.259 1.562 0 CA-C-O 127.568 3.556 . . . . 31.98 109.673 -174.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' A ARG . . . . . 0.452 ' O ' ' HG3' ' H' ' 77' A ARG . 9.8 ttp85 -32.91 -47.24 0.17 Allowed 'General case' 0 C--O 1.288 3.106 2 CA-C-O 106.823 -6.323 . . . . 38.36 115.866 -173.18 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' ASN . . . . . 0.761 ' N ' ' O ' ' H' ' 453' ' ' HOH . 28.3 m120 -127.32 23.18 6.44 Favored 'General case' 0 N--CA 1.493 1.715 1 CA-C-N 127.396 4.634 . . . . 33.42 110.916 175.635 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' ILE . . . . . 1.049 HD11 ' O ' ' H' ' 69' ' ' GLY 0.45 0.5 OUTLIER -109.95 -53.14 5.95 Favored 'Isoleucine or valine' 0 C--O 1.26 1.628 0 CA-C-O 114.079 -2.867 . . . . 36.07 109.666 179.5 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' H' ' 70' ' ' LYS . 8.6 pt-20 -89.14 153.99 20.51 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 113.528 -3.13 . . . . 30.79 113.402 -175.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' LYS . . . . . 0.601 ' HE3' ' O ' ' H' ' 468' ' ' HOH . 0.8 OUTLIER -127.19 134.45 50.14 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 121.04 1.746 . . . . 46.46 107.323 177.691 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 mt -103.95 134.86 44.05 Favored 'Isoleucine or valine' 0 C--O 1.269 2.124 0 CA-C-O 112.553 -3.594 . . . . 33.11 110.502 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -135.07 156.04 49.71 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 122.044 2.202 . . . . 33.69 110.051 179.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' MET . . . . . 0.733 ' CE ' HD11 ' H' ' 65' ' ' LEU . 0.1 OUTLIER -96.94 156.27 16.42 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 128.625 3.703 . . . . 50.0 101.22 -178.35 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' LEU . . . . . 0.668 HD13 ' HE2' ' H' ' 106' ' ' MET . 0.3 OUTLIER -105.6 149.02 26.67 Favored 'General case' 0 C--N 1.317 -0.84 1 O-C-N 129.663 4.352 . . . . 35.52 107.157 178.817 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -99.09 -40.03 8.21 Favored 'General case' 0 C--N 1.309 -1.187 1 CA-C-N 105.723 -5.217 . . . . 49.34 107.862 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' LYS . . . . . 0.801 ' HE3' ' H ' ' H' ' 88' ' ' ILE . 0.1 OUTLIER -154.25 156.28 36.75 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 120.638 1.563 . . . . 41.1 109.924 -178.38 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' ILE . . . . . 0.801 ' H ' ' HE3' ' H' ' 87' ' ' LYS . 14.6 mt -129.25 130.39 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 O-C-N 128.391 3.557 . . . . 35.99 102.517 179.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' TYR . . . . . 0.726 ' CE2' ' CE1' ' H' ' 245' ' ' PHE . 82.0 m-85 -133.55 117.78 17.51 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 112.123 -3.798 . . . . 38.96 106.083 -177.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' ILE . . . . . 0.775 HG23 ' CB ' ' H' ' 56' ' ' ALA . 2.4 mm -100.66 151.28 5.28 Favored 'Isoleucine or valine' 0 C--O 1.25 1.1 1 O-C-N 129.467 4.229 . . . . 30.91 105.868 178.721 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -60.66 127.52 87.16 Favored Pre-proline 0 N--CA 1.487 1.391 0 O-C-N 127.83 3.206 . . . . 27.63 106.086 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -58.38 -18.81 40.25 Favored 'Trans proline' 0 C--O 1.269 2.058 0 C-N-CA 121.142 1.228 . . . . 29.74 111.994 -177.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -115.42 21.08 14.36 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-O 115.839 -2.029 . . . . 37.09 114.128 -176.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' TYR . . . . . 0.552 ' HE1' HD22 ' H' ' 99' ' ' LEU . 1.1 t80 -57.77 121.79 11.29 Favored 'General case' 0 C--O 1.266 1.953 0 O-C-N 125.746 1.904 . . . . 24.57 109.814 171.138 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -87.12 84.43 7.28 Favored 'General case' 0 C--O 1.275 2.431 0 O-C-N 119.463 -2.023 . . . . 24.7 115.078 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -76.45 -18.61 58.7 Favored 'General case' 0 N--CA 1.504 2.255 1 C-N-CA 111.562 -4.055 . . . . 30.9 111.793 176.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -70.81 -40.82 72.28 Favored 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 126.814 2.046 . . . . 47.61 115.718 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' A GLU . . . . . 0.411 ' OE1' ' NH2' ' H' ' 175' ' ' ARG . 15.3 tt0 -116.28 -71.84 0.72 Allowed 'General case' 0 C--N 1.373 1.619 0 C-N-CA 118.286 -1.365 . . . . 45.36 111.068 -179.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' ASN . . . . . 0.681 ' ND2' ' O ' ' H' ' 175' ' ' ARG . 41.5 p-10 -119.96 20.4 12.17 Favored 'General case' 0 C--N 1.406 3.055 0 CA-C-O 113.345 -3.217 . . . . 23.73 119.012 -173.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' LEU . . . . . 0.552 HD22 ' HE1' ' H' ' 94' ' ' TYR . 4.9 mt 62.05 27.08 16.36 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 124.464 3.302 . . . . 27.27 112.093 179.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' ASP . . . . . 0.416 ' CG ' HG21 ' H' ' 177' ' ' THR . 16.7 t0 -58.76 131.12 49.95 Favored 'General case' 0 CA--C 1.559 1.317 0 N-CA-C 104.454 -2.424 . . . . 24.12 104.454 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' ARG . . . . . . . . . . . . . 14.3 mtm-85 65.61 40.36 4.53 Favored 'General case' 0 C--O 1.267 2.018 0 O-C-N 126.39 2.306 . . . . 35.52 115.134 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' ASP . . . . . 0.573 ' OD2' ' OG ' ' H' ' 214' ' ' SER . 44.3 t0 -77.08 83.36 3.58 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 113.366 -1.743 . . . . 17.7 107.622 175.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ILE . . . . . 0.874 HG21 HD12 ' H' ' 234' ' ' LEU . 2.3 tt -158.26 137.7 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 129.437 3.095 . . . . 19.65 109.766 -173.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ALA . . . . . . . . . . . . . . . -159.13 150.65 20.43 Favored 'General case' 0 C--N 1.363 1.193 0 N-CA-C 102.741 -3.059 . . . . 20.0 102.741 -178.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' LEU . . . . . . . . . . . . . 10.1 mt -120.01 133.64 55.48 Favored 'General case' 0 C--O 1.253 1.274 0 C-N-CA 128.58 2.752 . . . . 24.95 109.491 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' MET . . . . . 0.668 ' HE2' HD13 ' H' ' 85' ' ' LEU . 39.8 mtp -117.49 116.8 27.86 Favored 'General case' 0 C--O 1.27 2.154 1 O-C-N 132.018 5.824 . . . . 32.35 107.378 175.545 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' LYS . . . . . 0.945 ' CD ' HH21 ' H' ' 50' ' ' ARG . 0.0 OUTLIER -100.42 125.06 46.66 Favored 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 104.05 -2.574 . . . . 50.0 104.05 178.574 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' LEU . . . . . . . . . . . . . 19.3 mt -71.25 145.55 49.53 Favored 'General case' 0 CA--C 1.506 -0.715 0 O-C-N 127.06 2.725 . . . . 34.31 112.241 -168.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -20.81 64.47 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-O 122.655 1.217 . . . . 50.0 113.219 -179.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' LYS . . . . . 1.079 ' HG3' ' HD2' ' H' ' 111' ' ' PRO . 9.9 tptm -156.91 149.49 18.07 Favored Pre-proline 0 N--CA 1.468 0.455 0 C-N-CA 124.688 1.195 . . . . 49.93 109.063 177.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . 1.079 ' HD2' ' HG3' ' H' ' 110' ' ' LYS . 2.4 Cg_endo -65.51 154.81 72.03 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 O-C-N 125.083 2.096 . . . . 36.67 107.106 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' VAL . . . . . 0.854 HG23 ' O ' ' H' ' 49' ' ' ASP . 0.2 OUTLIER -103.4 159.78 4.68 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 C-N-CA 126.688 1.995 . . . . 35.22 106.902 179.631 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ALA . . . . . . . . . . . . . . . -107.92 139.77 42.05 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 110.391 -3.095 . . . . 31.13 103.355 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' PHE . . . . . 0.792 ' CZ ' ' HB3' ' H' ' 49' ' ' ASP . 11.4 m-30 -82.75 167.46 18.14 Favored 'General case' 0 C--O 1.265 1.878 1 O-C-N 131.047 5.217 . . . . 28.61 107.153 -174.191 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' SER . . . . . 0.597 ' OG ' ' N ' ' H' ' 116' ' ' ASP . 0.6 OUTLIER -167.52 -168.11 0.98 Allowed 'General case' 0 CA--C 1.501 -0.911 0 N-CA-C 101.65 -3.463 . . . . 26.89 101.65 -172.074 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . 0.597 ' N ' ' OG ' ' H' ' 115' ' ' SER . 84.5 m-20 -77.73 -11.39 59.87 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 126.972 2.67 . . . . 35.01 111.064 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -107.68 -20.25 13.28 Favored 'General case' 0 C--O 1.252 1.206 1 O-C-N 131.518 5.511 . . . . 26.4 113.898 -175.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' ILE . . . . . 0.531 ' CD1' ' HD3' ' H' ' 81' ' ' LYS . 9.7 mt -123.68 107.45 18.91 Favored 'Isoleucine or valine' 0 C--O 1.256 1.409 1 C-N-CA 133.596 4.758 . . . . 22.07 115.102 -176.309 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' HIS . . . . . 0.608 ' CD2' ' O ' ' L' ' 3' ' ' LEU . 51.9 t60 -148.21 135.94 10.9 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 112.243 -2.253 . . . . 27.27 109.949 -175.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -74.55 156.24 45.05 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 CA-C-N 124.03 2.475 . . . . 21.13 116.321 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' VAL . . . . . 0.41 HG11 ' HB2' ' H' ' 209' ' ' GLN . 3.4 p -96.15 158.72 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 118.211 -2.805 . . . . 17.99 106.535 177.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' CYS . . . . . 0.529 ' HA ' ' HA3' ' L' ' 1' D GLY . 91.0 m -90.87 147.5 23.12 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-O 113.077 -3.344 . . . . 17.81 110.644 -179.775 -68.329 -52.627 96.047 104.621 2.006 102.158 79.693 67.354 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' LEU . . . . . 1.142 ' O ' ' HA ' ' L' ' 1' E SER . 93.6 mt -93.47 140.64 23.23 Favored Pre-proline 0 C--N 1.298 -1.669 0 N-CA-C 104.37 -2.456 . . . . 21.93 104.37 172.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' PRO . . . . . 0.838 ' O ' ' NZ ' ' H' ' 235' ' ' LYS . 1.4 Cg_endo -72.2 153.2 56.7 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 123.167 2.578 . . . . 25.1 114.218 -174.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' ASP . . . . . 0.601 ' O ' ' N ' ' H' ' 127' ' ' GLU . 3.5 p30 -103.8 149.26 25.2 Favored 'General case' 0 C--O 1.273 2.296 0 O-C-N 126.272 2.232 . . . . 37.88 110.161 172.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . 0.597 ' C ' ' O ' ' H' ' 125' ' ' ASP . 48.7 ttt-85 -34.81 -33.96 0.03 OUTLIER 'General case' 0 C--O 1.251 1.153 1 O-C-N 116.078 -4.139 . . . . 50.0 112.716 -178.339 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' GLU . . . . . 0.601 ' N ' ' O ' ' H' ' 125' ' ' ASP . 0.2 OUTLIER -84.07 -36.12 23.27 Favored 'General case' 0 C--O 1.266 1.951 0 CA-C-N 122.99 2.632 . . . . 44.66 114.38 -174.158 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' THR . . . . . . . . . . . . . 92.0 m -66.4 -45.5 79.75 Favored 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 112.008 -2.36 . . . . 32.36 109.548 177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.4 -46.8 83.08 Favored 'General case' 0 C--N 1.288 -2.078 2 C-N-CA 132.933 4.493 . . . . 31.08 107.349 -179.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 129' A ALA . . . . . . . . . . . . . . . -68.18 -42.82 79.41 Favored 'General case' 0 C--O 1.257 1.483 0 O-C-N 117.105 -3.497 . . . . 32.86 110.551 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' B SER . . . . . . . . . . . . . 4.1 p -87.9 -5.86 58.36 Favored 'General case' 0 N--CA 1.493 1.677 0 CA-C-N 125.306 3.684 . . . . 40.34 116.09 -179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' C LEU . . . . . . . . . . . . . 17.1 mt -107.34 -40.28 5.43 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 117.121 -1.418 . . . . 27.99 111.143 -174.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 130' ' ' LEU . . . . . . . . . . . . . 6.2 mt -72.31 73.39 0.97 Allowed 'General case' 0 N--CA 1.498 1.971 1 O-C-N 130.667 4.979 . . . . 30.23 110.889 -176.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 131' ' ' GLN . . . . . 0.46 HE21 ' HB3' ' H' ' 131' ' ' GLN . 17.5 mt-30 -135.22 139.28 44.37 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-O 125.886 2.755 . . . . 47.81 108.889 -176.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 132' ' ' ALA . . . . . . . . . . . . . . . -61.34 138.67 58.25 Favored 'General case' 0 C--O 1.253 1.259 0 CA-C-O 113.61 -3.091 . . . . 30.2 103.164 -172.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 133' ' ' GLY . . . . . . . . . . . . . . . 103.15 -36.45 4.32 Favored Glycine 0 N--CA 1.48 1.581 1 O-C-N 135.239 7.837 . . . . 28.39 109.897 179.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 134' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -63.86 140.89 58.92 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 129.868 3.923 . . . . 32.92 108.905 178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 135' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' H' ' 160' ' ' LEU . 82.3 mttt -100.29 142.18 32.12 Favored 'General case' 0 C--O 1.211 -0.943 0 C-N-CA 125.494 1.517 . . . . 28.28 114.353 174.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 136' ' ' GLY . . . . . 0.516 ' HA3' ' CZ ' ' H' ' 199' ' ' PHE . . . -121.43 -178.81 15.92 Favored Glycine 0 CA--C 1.553 2.421 1 C-N-CA 134.039 5.59 . . . . 18.99 105.163 -179.589 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 137' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -137.8 137.54 38.3 Favored 'General case' 0 N--CA 1.441 -0.884 1 CA-C-O 106.371 -6.538 . . . . 22.72 104.739 -172.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 138' ' ' VAL . . . . . . . . . . . . . 1.4 t -122.12 154.82 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 1 O-C-N 134.585 7.428 . . . . 18.91 102.32 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 139' ' ' THR . . . . . 0.608 ' OG1' ' OE1' ' H' ' 30' ' ' GLN . 22.7 p -148.67 154.39 39.6 Favored 'General case' 0 N--CA 1.418 -2.055 0 CA-C-N 111.175 -2.739 . . . . 25.07 111.012 175.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 140' ' ' GLY . . . . . . . . . . . . . . . 167.19 164.14 22.32 Favored Glycine 0 C--N 1.282 -2.438 2 O-C-N 131.043 5.214 . . . . 19.25 110.772 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 141' ' ' TRP . . . . . 0.445 ' CZ3' ' HB2' ' H' ' 32' ' ' MET . 8.8 m-90 -101.98 12.43 36.91 Favored 'General case' 0 C--O 1.251 1.183 0 O-C-N 129.404 3.649 . . . . 28.55 110.781 -179.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 142' ' ' GLY . . . . . . . . . . . . . . . -68.4 -170.2 5.77 Favored Glycine 0 CA--C 1.54 1.656 2 O-C-N 109.301 -8.375 . . . . 27.84 111.523 -177.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 143' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -53.32 143.36 18.95 Favored 'General case' 0 C--O 1.208 -1.128 2 CA-C-O 107.96 -5.781 . . . . 38.66 110.269 -176.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 144' ' ' LEU . . . . . . . . . . . . . 18.1 mt -90.15 -17.53 27.46 Favored 'General case' 0 C--N 1.307 -1.26 2 O-C-N 133.618 6.823 . . . . 32.26 109.636 177.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 145' ' ' LYS . . . . . . . . . . . . 0.322 0.2 OUTLIER -157.08 158.29 36.16 Favored 'General case' 0 N--CA 1.506 2.373 1 O-C-N 130.675 4.984 . . . . 50.0 106.547 177.422 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 146' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' H' ' 146' ' ' GLU . 77.2 tt0 -54.54 -32.15 57.73 Favored 'General case' 0 CA--C 1.503 -0.859 0 O-C-N 128.254 3.471 . . . . 41.72 119.563 -171.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 147' ' ' THR . . . . . 0.654 HG22 ' O ' ' H' ' 521' ' ' HOH . 5.7 t . . . . . 0 C--O 1.294 3.409 1 C-N-CA 132.351 4.26 . . . . 46.31 101.908 -179.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 150' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.399 0 N-CA-C 109.462 -1.455 . . . . 39.25 109.462 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 151' ' ' GLN . . . . . 0.498 ' HB3' ' CZ ' ' H' ' 73' ' ' ARG . 1.6 mt-30 -98.26 151.57 37.57 Favored Pre-proline 0 N--CA 1.479 1.018 0 N-CA-C 107.205 -1.406 . . . . 49.79 107.205 177.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 152' ' ' PRO . . . . . 0.456 ' O ' ' NE ' ' H' ' 73' ' ' ARG . 6.5 Cg_endo -87.19 161.5 8.52 Favored 'Trans proline' 0 C--N 1.293 -2.381 0 C-N-CA 123.394 2.729 . . . . 34.98 105.225 -169.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 153' ' ' SER . . . . . . . . . . . . . 11.2 p -91.41 -27.93 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 126.539 2.4 . . . . 27.21 107.008 174.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 154' ' ' VAL . . . . . 0.949 ' CG1' ' HB3' ' H' ' 21' ' ' ASP 0.299 1.2 t -118.0 157.27 19.42 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.954 0 CA-C-O 124.584 2.135 . . . . 25.79 112.8 -179.256 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 155' ' ' LEU . . . . . . . . . . . . . 39.7 tp -51.53 137.49 24.25 Favored 'General case' 0 CA--C 1.489 -1.368 0 CA-C-O 115.915 -1.993 . . . . 23.01 110.72 171.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 156' ' ' GLN . . . . . 0.727 ' C ' HG13 ' H' ' 157' ' ' VAL . 21.5 mm100 -113.09 163.04 15.22 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-N 124.27 3.214 . . . . 18.96 107.358 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 157' ' ' VAL . . . . . 0.84 ' CG1' ' HB2' ' H' ' 22' ' ' ALA 0.269 6.1 m -145.53 147.13 18.9 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 2 O-C-N 129.611 4.32 . . . . 27.47 111.209 -179.965 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 158' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.25 149.47 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 1 O-C-N 130.328 4.767 . . . . 19.83 105.325 175.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 159' ' ' ASN . . . . . 0.492 ' CG ' HD11 ' L' ' 14' F LEU . 89.1 m-20 -107.52 134.57 50.35 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 111.81 -3.948 . . . . 25.13 103.471 -178.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 160' ' ' LEU . . . . . 0.538 ' O ' ' HA ' ' H' ' 135' ' ' LYS . 19.9 mt -129.88 151.91 79.01 Favored Pre-proline 0 C--N 1.275 -2.66 0 CA-C-O 126.482 3.039 . . . . 24.63 112.969 176.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 161' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -84.38 148.15 11.45 Favored 'Trans proline' 0 C--O 1.239 0.557 0 O-C-N 115.428 -2.985 . . . . 25.58 108.652 176.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 162' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.07 138.29 21.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.637 0 N-CA-C 101.584 -3.487 . . . . 27.59 101.584 176.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 163' ' ' VAL . . . . . . . . . . . . . 85.2 t -114.35 145.5 20.07 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 CA-C-O 124.657 2.17 . . . . 24.97 105.557 -174.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 164' ' ' GLU . . . . . . . . . . . . . 28.9 mp0 -61.89 134.68 56.98 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 110.949 -2.841 . . . . 49.9 109.264 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 165' ' ' ARG . . . . . 0.828 ' HB2' ' HD3' ' H' ' 166' ' ' PRO . 0.1 OUTLIER -46.75 -57.17 9.48 Favored Pre-proline 0 C--N 1.313 -1.02 0 C-N-CA 126.303 1.841 . . . . 50.0 112.463 -173.974 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 166' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' H' ' 165' ' ' ARG . 4.6 Cg_exo -51.93 -43.89 49.01 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 124.677 3.585 . . . . 29.25 108.925 -178.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 167' ' ' VAL . . . . . . . . . . . . . 50.7 t -59.17 -40.78 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-O 127.71 3.624 . . . . 28.37 107.649 174.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 168' ' ' CYS . . . . . . . . . . . . 0.317 75.6 m -54.36 -65.79 0.51 Allowed 'General case' 0 C--O 1.252 1.228 0 O-C-N 118.651 -2.531 . . . . 27.72 109.46 -176.863 -63.54 -66.179 -81.336 107.71 1.992 105.156 -85.551 91.115 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 169' ' ' LYS . . . . . . . . . . . . 0.355 3.6 mmtp -43.15 -53.55 4.93 Favored 'General case' 0 C--N 1.312 -1.037 0 C-N-CA 126.865 2.066 . . . . 47.83 115.361 175.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 170' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -59.15 -8.0 1.39 Allowed 'General case' 0 C--N 1.31 -1.123 1 C-N-CA 133.318 4.647 . . . . 23.06 114.374 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 171' ' ' SER . . . . . . . . . . . . . 19.7 p -108.68 -6.9 15.76 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 127.645 3.09 . . . . 24.21 111.588 -171.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 172' ' ' THR . . . . . . . . . . . . 0.313 2.1 t -145.98 178.18 8.39 Favored 'General case' 1 C--O 1.306 4.056 0 N-CA-C 106.266 -1.754 . . . . 22.0 106.266 -179.834 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' H' H ' 173' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' H' ' 173' ' ' ARG 0.264 8.5 mtp180 -114.59 -3.1 12.96 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-N 111.459 -2.61 . . . . 45.78 109.646 177.98 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 174' ' ' ILE . . . . . . . . . . . . . 8.2 mm -79.62 140.69 16.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.046 1 O-C-N 129.561 4.288 . . . . 22.43 107.115 176.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 175' ' ' ARG . . . . . 0.681 ' O ' ' ND2' ' H' ' 98' ' ' ASN . 35.2 ttp85 -82.54 118.36 23.21 Favored 'General case' 0 N--CA 1.512 2.67 0 CA-C-O 128.455 3.978 . . . . 29.95 110.076 176.38 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 176' ' ' ILE . . . . . 0.486 HD11 ' CH2' ' H' ' 215' ' ' TRP 0.296 1.1 mm -81.43 128.39 38.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.61 2 C-N-CA 136.267 5.827 . . . . 25.93 107.681 -178.897 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 177' ' ' THR . . . . . 0.631 ' O ' ' NH2' ' H' ' 165' ' ' ARG . 16.3 p -111.89 163.35 14.31 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.094 -3.504 . . . . 29.73 108.712 176.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 178' ' ' ASP . . . . . . . . . . . . . 77.5 m-20 -51.58 -25.06 6.15 Favored 'General case' 0 C--N 1.306 -1.297 1 C-N-CA 133.451 4.7 . . . . 30.76 113.187 175.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 179' ' ' ASN . . . . . . . . . . . . . 29.3 m-20 -74.43 10.98 1.09 Allowed 'General case' 0 C--O 1.28 2.677 1 CA-C-O 111.635 -4.031 . . . . 23.4 112.063 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 180' ' ' MET . . . . . . . . . . . . . 17.7 mtt -132.79 156.86 46.33 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 126.348 2.28 . . . . 18.04 108.957 -177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 181' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -144.19 158.65 43.61 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 102.057 -3.312 . . . . 16.45 102.057 172.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 182' ' ' CYS . . . . . 0.648 ' HA ' ' O ' ' H' ' 226' ' ' GLY . 0.7 OUTLIER -124.74 150.98 45.66 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 103.245 -2.872 . . . . 22.42 103.245 -177.839 91.115 -85.551 -81.336 105.156 1.992 107.71 -66.179 -63.54 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 183' ' ' ALA . . . . . . . . . . . . . . . -149.49 147.51 28.3 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 109.996 -3.274 . . . . 24.37 109.744 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 184' ' ' GLY . . . . . 0.49 ' O ' ' O ' ' H' ' 464' ' ' HOH . . . 152.54 171.16 19.79 Favored Glycine 0 N--CA 1.433 -1.565 1 C-N-CA 131.619 4.438 . . . . 19.5 114.227 179.316 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 184' A TYR . . . . . 0.707 ' O ' ' O ' ' H' ' 503' ' ' HOH . 96.3 m-85 -85.45 153.65 22.35 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.058 -1.26 . . . . 29.73 111.88 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 185' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' H' ' 186' B GLU . 4.8 mmtp -87.71 144.62 35.47 Favored Pre-proline 0 C--N 1.306 -1.304 0 O-C-N 117.352 -3.342 . . . . 40.46 106.454 175.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -63.67 -20.85 69.75 Favored 'Trans proline' 0 N--CA 1.484 0.954 0 N-CA-C 105.363 -2.591 . . . . 42.54 105.363 -170.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 186' A ASP . . . . . . . . . . . . 0.28 0.2 OUTLIER -68.12 -42.1 80.74 Favored 'General case' 0 N--CA 1.484 1.267 2 O-C-N 131.495 5.497 . . . . 50.0 102.725 -179.011 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 186' B GLU . . . . . 0.409 ' N ' ' O ' ' H' ' 185' ' ' LYS . 66.0 mt-10 -62.47 -34.82 77.57 Favored 'General case' 0 C--O 1.278 2.598 0 O-C-N 127.496 2.998 . . . . 49.13 116.576 -175.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' C GLY . . . . . . . . . . . . . . . 85.89 31.64 20.15 Favored Glycine 0 C--N 1.28 -2.583 1 O-C-N 114.133 -5.354 . . . . 42.33 110.208 161.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 186' D LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.62 142.1 29.89 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 126.985 2.227 . . . . 43.09 105.384 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 187' ' ' ARG . . . . . 0.414 ' HD3' ' OD2' ' H' ' 221' ' ' ASP . 0.0 OUTLIER -135.26 -162.43 1.26 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 117.772 -3.08 . . . . 31.57 113.464 179.616 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 188' ' ' GLY . . . . . 1.006 ' HA2' ' O ' ' H' ' 17' ' ' VAL . . . 125.13 152.41 8.26 Favored Glycine 1 C--N 1.404 4.336 4 C-N-CA 111.783 -5.008 . . . . 20.36 100.59 -177.788 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 189' ' ' ASP . . . . . 0.472 ' OD1' ' NH1' ' J' ' 4' ' ' OAR . 50.0 t0 -178.05 160.11 1.39 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 102.904 -2.999 . . . . 27.58 102.904 -177.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 190' ' ' ALA . . . . . . . . . . . . . . . -73.21 -173.33 1.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 103.056 -2.942 . . . . 23.58 103.056 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 191' ' ' CYS . . . . . 0.815 ' O ' ' HB2' ' H' ' 194' ' ' ASP . 10.5 t -167.94 170.67 10.4 Favored 'General case' 0 N--CA 1.483 1.221 1 N-CA-C 99.237 -4.357 . . . . 28.77 99.237 177.282 -164.27 42.833 84.784 100.104 2.013 99.268 178.438 -38.835 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 192' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' H' ' 191' ' ' CYS 0.513 0.0 OUTLIER -37.9 154.53 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 104.455 -2.424 . . . . 45.51 104.455 171.972 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 193' ' ' GLY . . . . . . . . . . . . . . . 80.44 -25.15 3.36 Favored Glycine 0 C--O 1.262 1.865 0 C-N-CA 130.23 3.776 . . . . 24.56 112.735 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 194' ' ' ASP . . . . . 0.815 ' HB2' ' O ' ' H' ' 191' ' ' CYS . 41.5 m-20 -76.05 -31.99 59.09 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 129.714 3.206 . . . . 29.35 112.223 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 195' ' ' SER . . . . . 1.127 ' CB ' ' HC2' ' J' ' 4' ' ' OAR . 0.1 OUTLIER -41.02 147.35 0.13 Allowed 'General case' 0 C--O 1.202 -1.439 0 O-C-N 119.568 -1.957 . . . . 28.11 114.651 -178.162 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.3 -7.96 80.9 Favored Glycine 0 C--O 1.251 1.214 0 CA-C-O 125.898 2.943 . . . . 18.77 110.011 175.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 197' ' ' GLY . . . . . . . . . . . . . . . -77.09 176.41 53.28 Favored Glycine 0 C--N 1.348 1.243 1 O-C-N 114.611 -5.053 . . . . 20.77 105.536 -173.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 198' ' ' PRO . . . . . . . . . . . . 0.279 2.1 Cg_endo -93.77 145.34 2.02 Favored 'Trans proline' 0 C--O 1.267 1.953 0 CA-C-N 113.411 -1.394 . . . . 19.65 113.376 176.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 199' ' ' PHE . . . . . 0.516 ' CZ ' ' HA3' ' H' ' 136' ' ' GLY . 10.9 t80 -111.19 123.1 49.52 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 100.436 -3.913 . . . . 14.42 100.436 168.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 200' ' ' VAL . . . . . . . . . . . . . 2.7 m -141.34 153.43 19.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.424 2 O-C-N 112.709 -6.245 . . . . 20.59 110.326 -170.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' MET . . . . . 1.327 ' CE ' ' HG3' ' H' ' 210' ' ' MET . 37.0 mtm -129.47 154.07 47.34 Favored 'General case' 0 C--O 1.268 2.071 0 CA-C-N 108.964 -3.743 . . . . 20.72 105.796 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' LYS . . . . . 0.697 ' HE3' ' OE2' ' L' ' 8' ' ' GLU . 10.2 tttm -101.06 119.9 39.42 Favored 'General case' 0 N--CA 1.491 1.577 1 O-C-N 129.679 4.362 . . . . 24.48 109.201 177.092 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' SER . . . . . 0.73 ' HB3' HD21 ' H' ' 204' B ASN . 30.9 t -67.19 131.7 93.53 Favored Pre-proline 0 C--O 1.274 2.364 0 O-C-N 125.996 2.06 . . . . 17.74 113.022 175.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' PRO . . . . . 0.415 ' HG3' ' HD2' ' L' ' 14' J TYR . 1.1 Cg_endo -79.39 -6.85 14.83 Favored 'Trans proline' 0 C--O 1.267 1.934 0 CA-C-N 111.72 -1.921 . . . . 20.08 110.68 175.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 204' A PHE . . . . . . . . . . . . . 34.1 m-85 -86.77 -49.61 7.33 Favored 'General case' 0 N--CA 1.51 2.549 0 C-N-CA 123.518 0.727 . . . . 25.62 111.293 -176.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 204' B ASN . . . . . 0.835 ' C ' HD22 ' H' ' 204' B ASN . 0.1 OUTLIER -121.09 14.93 11.49 Favored 'General case' 0 C--O 1.273 2.335 0 CA-C-N 112.441 -2.163 . . . . 23.38 116.011 179.736 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' ASN . . . . . 0.515 ' O ' ' HE2' ' H' ' 202' ' ' LYS . 1.0 OUTLIER 57.37 8.51 0.61 Allowed 'General case' 0 C--O 1.255 1.39 0 N-CA-C 117.947 2.573 . . . . 34.84 117.947 175.847 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' ARG . . . . . . . . . . . . . 24.1 mtt-85 -83.35 153.32 24.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 128.147 2.579 . . . . 30.49 115.492 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' TRP . . . . . 0.501 ' CE2' ' HD2' ' H' ' 202' ' ' LYS . 94.1 m95 -95.53 124.71 39.69 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-O 116.408 -1.758 . . . . 19.15 112.986 177.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -113.94 142.96 45.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 119.776 1.171 . . . . 24.72 112.118 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' GLN . . . . . 0.41 ' HB2' HG11 ' H' ' 121' ' ' VAL . 61.0 tt0 -94.16 109.95 21.71 Favored 'General case' 0 C--O 1.273 2.337 0 CA-C-N 124.061 3.118 . . . . 17.57 107.604 172.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' MET . . . . . 1.327 ' HG3' ' CE ' ' H' ' 201' ' ' MET . 6.6 mmt -81.98 -38.92 24.39 Favored 'General case' 0 C--O 1.28 2.703 0 CA-C-O 124.88 2.276 . . . . 28.19 116.077 173.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' GLY . . . . . . . . . . . . . . . -130.87 153.69 20.41 Favored Glycine 0 N--CA 1.497 2.75 0 O-C-N 117.87 -3.019 . . . . 18.53 118.811 -174.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' ILE . . . . . 0.45 HD12 HD12 ' H' ' 103' ' ' ILE . 43.4 mt -112.73 129.24 68.7 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.317 0 O-C-N 118.79 -2.594 . . . . 19.83 107.568 171.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' VAL . . . . . . . . . . . . . 20.5 t -57.89 110.24 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.391 1 O-C-N 114.919 -4.863 . . . . 21.52 107.99 -177.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' SER . . . . . 0.573 ' OG ' ' OD2' ' H' ' 102' ' ' ASP . 0.8 OUTLIER -109.63 -69.67 0.85 Allowed 'General case' 0 C--O 1.272 2.245 0 N-CA-C 116.224 1.935 . . . . 19.11 116.224 -173.689 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 215' ' ' TRP . . . . . 0.486 ' CH2' HD11 ' H' ' 176' ' ' ILE . 37.3 p-90 -156.53 165.92 34.89 Favored 'General case' 0 CA--C 1.478 -1.808 0 C-N-CA 115.344 -2.542 . . . . 25.12 106.797 -177.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 216' ' ' GLY . . . . . 0.602 ' O ' ' N ' ' J' ' 2' ' ' LEU . . . -164.93 151.64 20.73 Favored Glycine 0 CA--C 1.547 2.072 0 CA-C-O 114.552 -3.36 . . . . 20.96 104.964 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 217' ' ' GLU . . . . . 0.787 ' HB2' ' HD3' ' H' ' 224' ' ' LYS . 0.2 OUTLIER -75.46 100.39 4.48 Favored 'General case' 1 C--N 1.493 6.847 0 O-C-N 128.77 3.277 . . . . 33.27 110.46 169.638 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 219' ' ' GLY . . . . . 0.796 ' N ' ' O4 ' ' J' ' 1' ' ' 34H . . . 54.56 154.25 0.01 OUTLIER Glycine 0 C--N 1.27 -3.096 0 N-CA-C 109.864 -1.294 . . . . 28.53 109.864 -175.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 220' ' ' CYS . . . . . . . . . . . . . 3.7 m -84.21 132.15 34.68 Favored 'General case' 0 C--O 1.258 1.545 0 CA-C-O 127.156 3.36 . . . . 30.29 114.823 176.474 -38.835 178.438 84.784 99.268 2.013 100.104 42.833 -164.27 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 221' ' ' ASP . . . . . 0.414 ' OD2' ' HD3' ' H' ' 187' ' ' ARG . 23.2 t0 50.94 38.17 19.49 Favored 'General case' 0 C--O 1.272 2.284 0 O-C-N 116.449 -3.907 . . . . 33.39 112.815 176.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 221' A ARG . . . . . 0.683 HH22 ' H5 ' ' J' ' 1' ' ' 34H . 4.6 mmt85 -82.41 136.27 34.99 Favored 'General case' 0 C--O 1.264 1.832 0 O-C-N 117.059 -3.526 . . . . 41.02 106.103 173.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 222' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.77 131.98 30.95 Favored 'General case' 0 C--N 1.313 -0.985 0 O-C-N 118.179 -2.826 . . . . 49.44 111.388 172.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 223' ' ' GLY . . . . . . . . . . . . . . . 76.98 4.11 82.39 Favored Glycine 0 C--O 1.248 1.003 0 O-C-N 120.226 -1.546 . . . . 34.41 115.315 176.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 224' ' ' LYS . . . . . 0.787 ' HD3' ' HB2' ' H' ' 217' ' ' GLU . 17.0 mttp -114.1 156.27 24.48 Favored 'General case' 0 C--O 1.261 1.67 0 N-CA-C 107.306 -1.368 . . . . 35.37 107.306 174.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 225' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -132.25 150.41 52.16 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 126.927 2.091 . . . . 31.16 113.885 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 226' ' ' GLY . . . . . 0.648 ' O ' ' HA ' ' H' ' 182' ' ' CYS . . . -76.91 150.61 37.89 Favored Glycine 0 CA--C 1.489 -1.54 0 N-CA-C 104.076 -3.61 . . . . 22.73 104.076 178.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 227' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 -115.82 142.71 46.4 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 108.995 -3.603 . . . . 18.47 110.886 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 228' ' ' TYR . . . . . 0.423 ' HB3' ' O ' ' H' ' 212' ' ' ILE . 44.2 m-85 -139.29 143.09 37.75 Favored 'General case' 0 N--CA 1.486 1.36 0 CA-C-O 112.234 -3.746 . . . . 20.57 113.612 -175.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 229' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.11 143.21 57.99 Favored 'General case' 0 C--O 1.265 1.874 0 O-C-N 126.82 2.575 . . . . 16.81 110.19 173.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 230' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -89.91 90.26 8.09 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.865 1.666 . . . . 27.67 109.264 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 231' ' ' VAL . . . . . 0.51 ' HB ' ' O ' ' H' ' 210' ' ' MET . 4.2 t -54.12 -46.29 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 CA-C-O 114.238 -2.791 . . . . 19.32 108.814 -172.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 232' ' ' PHE . . . . . 0.477 ' CZ ' ' HA ' ' H' ' 126' ' ' ARG . 69.1 t80 -59.65 -45.88 90.68 Favored 'General case' 0 N--CA 1.509 2.514 0 C-N-CA 116.087 -2.245 . . . . 31.76 113.899 178.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 233' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -55.9 -21.52 20.84 Favored 'General case' 0 C--O 1.248 1.003 1 O-C-N 114.616 -5.053 . . . . 34.63 107.884 -176.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 234' ' ' LEU . . . . . 0.874 HD12 HG21 ' H' ' 103' ' ' ILE . 1.5 mt -107.69 3.21 24.42 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 115.714 -2.395 . . . . 26.58 114.49 -175.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 235' ' ' LYS . . . . . 0.838 ' NZ ' ' O ' ' H' ' 124' ' ' PRO . 36.2 tttt -55.59 -39.53 70.86 Favored 'General case' 0 C--O 1.262 1.756 0 CA-C-N 117.717 0.235 . . . . 35.19 110.545 -175.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 236' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -36.03 82.26 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 114.441 -2.904 . . . . 50.0 110.634 -175.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 237' ' ' TRP . . . . . . . . . . . . . 52.2 t90 -67.29 -49.29 64.85 Favored 'General case' 0 CA--C 1.507 -0.694 0 O-C-N 118.295 -2.753 . . . . 31.93 104.424 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 238' ' ' ILE . . . . . 0.42 HD11 HD11 ' H' ' 103' ' ' ILE . 89.3 mt -59.08 -34.94 54.73 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 O-C-N 127.523 3.014 . . . . 30.77 110.566 179.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 239' ' ' GLN . . . . . 0.471 ' N ' ' O ' ' H' ' 235' ' ' LYS . 0.0 OUTLIER -66.3 -47.15 74.53 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 124.438 1.086 . . . . 50.0 108.465 -178.997 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 240' ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' H' ' 244' ' ' GLN . 0.0 OUTLIER -53.53 -63.45 1.14 Allowed 'General case' 0 C--O 1.262 1.741 0 CA-C-O 114.614 -2.613 . . . . 50.0 115.177 177.47 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 241' ' ' VAL . . . . . 0.563 ' HB ' ' CE1' ' H' ' 245' ' ' PHE . 0.6 OUTLIER -58.9 -33.29 49.32 Favored 'Isoleucine or valine' 0 C--O 1.267 1.99 0 CA-C-N 124.6 3.364 . . . . 41.31 113.473 -176.514 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 242' ' ' ILE . . . . . 0.833 ' O ' ' HA3' ' H' ' 246' ' ' GLY . 47.2 mt -67.63 -44.79 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 C-N-CA 117.285 -1.766 . . . . 43.17 109.19 -178.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 243' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.6 -44.97 94.96 Favored 'General case' 0 N--CA 1.491 1.611 1 CA-C-O 130.606 5.003 . . . . 50.0 107.069 179.656 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 244' ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' H' ' 240' ' ' LYS 0.259 3.7 mm100 -55.52 -43.88 76.14 Favored 'General case' 0 C--N 1.314 -0.958 1 CA-C-N 105.393 -5.367 . . . . 50.0 112.204 -175.46 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' H' H ' 245' ' ' PHE . . . . . 0.726 ' CE1' ' CE2' ' H' ' 89' ' ' TYR . 0.3 OUTLIER -161.02 31.0 0.14 Allowed 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 114.808 -2.757 . . . . 50.0 108.388 -179.733 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 246' ' ' GLY . . . . . 0.833 ' HA3' ' O ' ' H' ' 242' ' ' ILE . . . -72.66 -160.09 5.13 Favored Glycine 0 C--O 1.259 1.705 1 N-CA-C 126.405 5.322 . . . . 50.0 126.405 -178.313 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 247' ' ' GLU . . . . . 1.093 ' CG ' ' HG3' ' H' ' 50' ' ' ARG 0.268 2.2 mm-40 . . . . . 0 C--O 1.277 2.518 0 CA-C-N 109.323 -3.439 . . . . 50.0 107.93 176.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 355' ' ' ASP . . . . . 0.676 ' HB3' ' O ' ' I' ' 553' ' ' HOH . 47.0 t0 . . . . . 0 N--CA 1.504 2.232 0 CA-C-O 128.286 3.898 . . . . 50.0 105.321 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 356' ' ' PHE . . . . . 0.463 ' HA ' ' HB ' ' H' ' 74' ' ' THR . 45.0 m-85 -76.28 115.25 15.83 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 109.454 -3.521 . . . . 43.98 111.393 178.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 357' ' ' GLU . . . . . 0.897 ' OE1' ' HD3' ' H' ' 75' ' ' ARG . 40.4 tt0 -56.04 158.92 3.6 Favored 'General case' 0 C--O 1.248 1.01 0 O-C-N 125.481 1.738 . . . . 45.78 106.418 174.768 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 358' ' ' GLU . . . . . 0.652 ' N ' ' HG2' ' I' ' 357' ' ' GLU . 0.0 OUTLIER -72.32 145.36 47.86 Favored 'General case' 0 C--O 1.265 1.888 0 N-CA-C 114.516 1.302 . . . . 50.0 114.516 -172.161 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 359' ' ' ILE . . . . . 0.529 HG23 ' NE2' ' H' ' 38' ' ' GLN . 0.1 OUTLIER -107.52 149.97 39.52 Favored Pre-proline 0 C--O 1.242 0.707 0 CA-C-O 111.969 -3.872 . . . . 50.0 107.728 177.521 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 360' ' ' PRO . . . . . 0.872 ' HG2' ' CD2' ' I' ' 363' ' ' TYS . 9.4 Cg_endo -68.4 126.23 13.94 Favored 'Trans proline' 0 N--CA 1.441 -1.574 2 O-C-N 132.075 5.776 . . . . 50.0 115.877 178.355 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' I' I ' 361' ' ' GLU . . . . . 0.601 ' C ' ' N ' ' I' ' 363' ' ' TYS . . . -52.09 -25.67 9.3 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-N 110.523 -3.035 . . . . 50.0 110.842 -175.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 362' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -55.73 -18.39 8.13 Favored 'General case' 0 N--CA 1.495 1.799 0 N-CA-C 102.112 -3.292 . . . . 50.0 102.112 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 363' ' ' TYS . . . . . 0.872 ' CD2' ' HG2' ' I' ' 360' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 364' ' ' LEU . . . . . 0.418 HD11 ' OE1' ' H' ' 38' ' ' GLN . 20.8 mt . . . . . 0 C--O 1.27 2.139 0 CA-C-O 114.94 -2.457 . . . . 50.0 106.646 179.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 1' ' ' 34H . . . . . 0.796 ' O4 ' ' N ' ' H' ' 219' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 2' ' ' LEU . . . . . 0.732 HD21 ' OE1' ' H' ' 217' ' ' GLU 0.332 0.1 OUTLIER . . . . . 0 C--O 1.245 0.843 0 N-CA-C 100.99 -3.707 . . . . 35.33 100.99 . . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' J' J ' 3' ' ' PRJ . . . . . 0.816 ' H13' ' CZ2' ' H' ' 60' D TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 4' ' ' OAR . . . . . 1.127 ' HC2' ' CB ' ' H' ' 195' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 626' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 453' ' ' HOH . . . . . 0.761 ' O ' ' N ' ' H' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 460' ' ' HOH . . . . . 0.438 ' O ' ' O ' ' H' ' 64' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 464' ' ' HOH . . . . . 0.49 ' O ' ' O ' ' H' ' 184' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 468' ' ' HOH . . . . . 0.601 ' O ' ' HE3' ' H' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 473' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 475' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 479' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 483' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 489' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 492' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 496' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 497' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 500' ' ' HOH . . . . . 0.662 ' O ' HD11 ' H' ' 79' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 503' ' ' HOH . . . . . 0.707 ' O ' ' O ' ' H' ' 184' A TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 521' ' ' HOH . . . . . 0.654 ' O ' HG22 ' H' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 529' ' ' HOH . . . . . 0.706 ' O ' ' CA ' ' L' ' 1' D GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 550' ' ' HOH . . . . . 0.465 ' O ' ' ND2' ' H' ' 60' G ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 583' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 586' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 587' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 588' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 589' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 590' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 593' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 594' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 595' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 596' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 597' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 598' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 599' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 600' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 615' ' ' HOH . . . . . 0.691 ' O ' ' O ' ' H' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 616' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 553' ' ' HOH . . . . . 0.676 ' O ' ' HB3' ' I' ' 355' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 462' ' ' HOH . . . . . 0.726 ' O ' ' HG3' ' J' ' 4' ' ' OAR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 494' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 591' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 592' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 495' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_