data_1ivp_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 1ivp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo . . . . . 0 CA--C 1.54 0.797 0 N-CA-C 117.041 1.9 . . . . 26.73 117.041 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . 0.28 0.0 OUTLIER -89.94 157.96 17.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 103.335 -2.839 . . . . 27.91 103.335 176.849 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -137.73 116.53 12.28 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.214 -2.266 . . . . 23.16 110.822 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m -81.79 146.22 30.04 Favored 'General case' 0 C--O 1.272 2.271 1 N-CA-C 100.036 -4.061 . . . . 19.66 100.036 178.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.432 72.6 mt -104.49 15.56 27.88 Favored 'General case' 0 N--CA 1.489 1.503 1 O-C-N 133.202 6.564 . . . . 15.79 107.898 179.163 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.1 m95 -65.6 -33.47 75.98 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 126.359 2.98 . . . . 16.99 110.863 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -118.55 158.49 25.31 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-N 110.693 -2.958 . . . . 15.01 103.926 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -67.72 125.25 91.04 Favored Pre-proline 0 N--CA 1.485 1.314 0 CA-C-O 114.167 -2.825 . . . . 14.77 105.767 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -66.49 55.01 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 128.107 3.688 . . . . 14.15 117.007 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.41 125.14 40.1 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 C-N-CA 129.961 3.304 . . . . 18.33 110.07 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . 0.284 0.3 OUTLIER -127.82 166.65 24.36 Favored 'Isoleucine or valine' 0 C--O 1.26 1.641 0 N-CA-C 102.165 -3.272 . . . . 19.06 102.165 -179.115 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.47 129.28 48.93 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 115.998 -1.953 . . . . 20.97 113.081 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . 0.663 ' N ' ' O ' ' A' ' 20' ' ' VAL . . . -120.28 160.21 23.45 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.709 1.595 . . . . 22.17 112.834 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -108.1 102.81 11.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 114.14 -2.838 . . . . 23.43 107.166 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . 0.519 ' N ' ' O ' ' A' ' 18' ' ' GLN 0.251 64.7 mt -91.69 89.45 2.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 C-N-CA 116.704 -1.998 . . . . 26.62 108.111 -179.411 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 56.77 71.73 0.55 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 111.099 -2.773 . . . . 29.41 109.929 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.0 -31.88 1.76 Allowed Glycine 0 C--O 1.254 1.362 0 O-C-N 126.782 2.551 . . . . 25.86 111.951 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.0 mt-30 -81.69 113.96 46.43 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 127.175 2.338 . . . . 23.84 112.68 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -72.13 139.65 32.92 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 123.459 2.773 . . . . 22.64 109.053 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . 0.663 ' O ' ' N ' ' A' ' 13' ' ' ALA 0.253 1.2 t -158.38 146.25 8.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 O-C-N 125.148 1.53 . . . . 20.33 112.969 -179.702 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -95.15 128.78 42.25 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 107.448 -1.315 . . . . 17.44 107.448 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.3 m -131.97 156.32 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 125.657 1.848 . . . . 13.61 111.796 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -102.33 129.44 48.78 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 123.34 1.543 . . . . 8.73 108.645 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' LEU . 2.6 mp -78.51 102.69 8.01 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 104.096 -2.557 . . . . 8.91 104.096 176.885 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . 0.575 ' OD2' ' OH ' ' B' ' 100' ' ' 1ZK . 43.8 t0 -119.25 105.65 11.55 Favored 'General case' 0 C--O 1.257 1.448 0 N-CA-C 116.127 1.899 . . . . 9.03 116.127 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.9 p -73.31 10.67 0.93 Allowed 'General case' 0 C--N 1.299 -1.629 0 O-C-N 126.69 2.494 . . . . 5.87 114.928 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -129.27 24.49 4.71 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 125.278 1.418 . . . . 5.78 114.009 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.46 129.94 51.98 Favored 'General case' 0 C--O 1.259 1.563 1 C-N-CA 134.314 5.046 . . . . 7.45 108.95 178.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -84.45 -31.66 24.47 Favored 'General case' 0 C--O 1.278 2.555 0 N-CA-C 105.244 -2.132 . . . . 13.61 105.244 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -128.12 167.95 16.07 Favored 'General case' 0 C--O 1.261 1.684 0 N-CA-C 119.222 3.045 . . . . 14.81 119.222 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.8 127.42 54.0 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-N 112.915 -1.948 . . . . 13.35 111.551 -177.675 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.3 mt -127.19 120.56 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 127.241 2.838 . . . . 14.23 109.32 -178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.59 136.93 55.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.773 0 O-C-N 128.273 3.483 . . . . 17.41 106.267 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.76 -179.18 7.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 103.999 -2.593 . . . . 20.44 103.999 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -5.79 76.17 0.0 OUTLIER Glycine 0 N--CA 1.406 -3.305 1 N-CA-C 124.841 4.696 . . . . 24.47 124.841 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 6.6 pt -135.55 150.75 29.15 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 131.693 3.997 . . . . 25.94 100.431 176.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -108.4 118.69 37.42 Favored 'General case' 0 C--N 1.317 -0.848 0 O-C-N 128.579 3.674 . . . . 27.38 108.687 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 12.7 mt -116.08 -4.51 11.97 Favored 'General case' 0 C--O 1.259 1.604 0 C-N-CA 127.363 2.265 . . . . 24.62 115.901 -177.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.15 -130.98 9.46 Favored Glycine 0 CA--C 1.483 -1.956 1 N-CA-C 130.309 6.883 . . . . 26.43 130.309 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -130.8 -23.34 2.54 Favored 'General case' 0 C--O 1.272 2.276 1 N-CA-C 122.756 4.354 . . . . 28.97 122.756 -177.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -82.47 66.27 7.99 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 124.554 1.158 . . . . 28.04 109.204 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . 0.414 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 37.0 p90 -118.36 158.5 25.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 126.595 3.093 . . . . 24.16 112.725 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . . . -138.08 127.35 14.78 Favored Pre-proline 0 C--N 1.297 -1.688 1 C-N-CA 132.59 4.356 . . . . 21.65 104.691 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -76.63 137.1 17.86 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 O-C-N 125.426 2.277 . . . . 19.54 107.932 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . 0.683 ' O ' ' N ' ' A' ' 56' ' ' THR 0.273 72.3 mmtt -138.28 162.9 33.16 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 126.252 2.22 . . . . 21.36 109.3 176.153 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 5.9 pt -120.51 139.53 47.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 N-CA-C 105.413 -2.069 . . . . 17.67 105.413 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.9 m -117.32 157.55 18.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 125.638 2.637 . . . . 14.57 108.199 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.77 157.15 20.92 Favored Glycine 0 CA--C 1.54 1.654 1 C-N-CA 131.695 4.474 . . . . 15.04 114.776 178.828 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -167.08 -164.87 23.51 Favored Glycine 0 C--O 1.254 1.378 1 CA-C-O 111.474 -5.07 . . . . 18.37 109.959 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . 0.332 2.7 pp -58.19 -37.27 61.47 Favored 'Isoleucine or valine' 0 C--O 1.277 2.526 1 CA-C-N 124.704 4.252 . . . . 16.46 120.844 -179.381 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -82.93 -18.24 65.74 Favored Glycine 0 N--CA 1.493 2.454 0 CA-C-O 126.243 3.135 . . . . 15.7 113.997 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 154.31 -135.24 4.64 Favored Glycine 0 C--N 1.301 -1.409 0 O-C-N 117.088 -3.596 . . . . 14.67 112.162 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -123.62 135.67 54.07 Favored 'General case' 0 C--N 1.314 -0.948 1 C-N-CA 133.458 4.703 . . . . 17.87 115.907 -175.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.6 mt -115.88 158.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 O-C-N 127.883 3.24 . . . . 16.85 109.904 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -96.91 138.4 34.51 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 103.617 -2.734 . . . . 19.86 103.617 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . 0.683 ' N ' ' O ' ' A' ' 45' ' ' LYS . 78.7 p -134.52 170.9 15.07 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.876 1.985 . . . . 16.97 110.045 179.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . -120.78 104.25 9.74 Favored 'General case' 0 N--CA 1.44 -0.969 1 C-N-CA 132.738 4.415 . . . . 18.08 108.55 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' OE1' ' CG2' ' A' ' 74' ' ' THR . 0.2 OUTLIER -89.48 122.08 32.32 Favored 'General case' 0 C--O 1.256 1.43 0 O-C-N 127.262 2.851 . . . . 20.71 113.329 -179.687 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -119.45 141.39 49.18 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 105.223 -2.14 . . . . 19.6 105.223 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -106.19 165.45 11.22 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 125.388 2.518 . . . . 21.07 112.492 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . . . 26.78 50.54 0.02 OUTLIER 'General case' 0 C--O 1.253 1.245 0 CA-C-N 111.121 -2.763 . . . . 23.68 113.113 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . 0.306 0.9 OUTLIER -79.52 153.14 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 116.341 -2.143 . . . . 23.38 105.497 179.822 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . 0.695 ' OE1' ' NZ ' ' A' ' 70' ' ' LYS 0.335 30.8 mt-10 -89.86 136.6 32.95 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 121.846 2.112 . . . . 26.9 110.263 179.34 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . 0.468 ' N ' ' O ' ' A' ' 71' ' ' VAL . 10.8 mt -137.68 137.28 45.48 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 125.235 1.414 . . . . 21.86 114.219 -177.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -125.56 124.86 42.2 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 106.096 -1.816 . . . . 25.84 106.096 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.0 p -151.12 142.94 16.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 105.437 -2.06 . . . . 21.41 105.437 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . 0.474 ' CD1' ' CD2' ' B' ' 99' ' ' LEU . 62.9 mt 53.59 36.21 22.93 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.799 -1.926 . . . . 23.84 105.799 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.275 51.7 t-20 57.15 30.25 17.99 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 112.0 -2.363 . . . . 27.21 113.161 176.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.08 155.44 43.28 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 126.347 2.279 . . . . 28.63 107.401 -178.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . 0.695 ' NZ ' ' OE1' ' A' ' 63' ' ' GLU . 10.4 mmmt -105.68 155.12 19.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 N-CA-C 119.532 3.16 . . . . 28.4 119.532 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . 0.566 ' CG1' ' N ' ' A' ' 72' ' ' ARG . 4.4 t -171.01 155.39 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.83 0 CA-C-O 123.452 1.596 . . . . 23.33 110.554 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . 0.566 ' N ' ' CG1' ' A' ' 71' ' ' VAL . 4.9 ttt180 -123.63 121.99 36.99 Favored 'General case' 0 C--O 1.27 2.17 1 N-CA-C 100.153 -4.017 . . . . 29.77 100.153 177.273 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.77 159.33 29.91 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 113.865 -2.969 . . . . 19.97 111.44 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . 0.477 ' CG2' ' OE1' ' A' ' 58' ' ' GLU . 1.9 m -55.37 132.41 48.06 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 124.031 3.105 . . . . 17.3 115.852 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.6 mm -123.19 123.9 68.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 O-C-N 117.714 -3.116 . . . . 15.93 111.697 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -107.08 121.57 44.75 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 127.006 2.692 . . . . 21.19 109.65 -178.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -95.44 149.08 21.78 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 125.591 3.814 . . . . 19.05 111.837 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.42 179.37 45.92 Favored Glycine 0 N--CA 1.476 1.304 0 CA-C-O 125.705 2.836 . . . . 20.7 119.343 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -87.34 69.14 9.93 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 128.308 2.643 . . . . 24.91 115.065 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.54 132.29 21.02 Favored Pre-proline 0 C--N 1.318 -0.796 0 C-N-CA 131.307 3.843 . . . . 20.7 110.348 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo -59.11 -31.57 95.74 Favored 'Trans proline' 0 C--O 1.255 1.347 0 O-C-N 124.695 1.892 . . . . 19.78 109.949 177.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 19.6 mt -139.95 152.76 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 117.417 -1.713 . . . . 17.96 109.196 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.95 116.02 19.86 Favored 'General case' 0 CA--C 1.561 1.377 0 O-C-N 128.221 3.451 . . . . 14.21 104.114 178.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 10.2 pt -102.82 135.59 39.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 115.026 -2.416 . . . . 12.08 109.817 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 1.1 m-30 -113.39 99.24 7.63 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 127.177 2.798 . . . . 10.97 105.372 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.68 -172.28 48.04 Favored Glycine 0 CA--C 1.49 -1.527 0 N-CA-C 119.169 2.427 . . . . 10.3 119.169 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . 0.551 ' NH1' ' O ' ' B' ' 5' ' ' LEU . 41.3 mtm105 -55.57 -27.06 46.95 Favored 'General case' 0 C--O 1.28 2.669 0 N-CA-C 119.127 3.01 . . . . 11.11 119.127 -176.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' N ' ' OD1' ' A' ' 88' ' ' ASN . 21.6 p-10 -62.64 -35.36 79.35 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 124.955 1.409 . . . . 13.83 111.108 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 6.4 mt -90.74 -36.98 8.77 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 C-N-CA 126.239 1.816 . . . . 14.09 109.774 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.75 -32.83 67.85 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 120.241 -0.584 . . . . 12.76 109.88 178.296 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -78.85 -31.92 45.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 118.328 -2.732 . . . . 12.86 112.886 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.19 91.95 Favored 'General case' 0 C--O 1.254 1.336 0 C-N-CA 128.448 2.699 . . . . 14.01 107.989 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.6 mt -81.13 -16.34 53.3 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.636 -1.62 . . . . 15.24 114.113 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.7 26.92 48.76 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 127.768 2.604 . . . . 15.7 112.946 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmm -73.63 156.9 37.53 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 126.764 2.025 . . . . 18.09 108.13 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 83.0 p -148.92 171.68 15.93 Favored 'General case' 0 N--CA 1.487 1.392 1 O-C-N 129.476 4.235 . . . . 16.81 109.757 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.4 mt -119.01 129.08 54.95 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 102.924 -2.991 . . . . 18.09 102.924 177.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -124.28 144.65 49.86 Favored 'General case' 0 C--O 1.251 1.175 0 O-C-N 127.406 2.941 . . . . 21.77 108.152 -179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.256 1.409 0 CA-C-O 126.336 2.969 . . . . 19.13 113.58 177.149 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PRO . . . . . 0.713 ' N ' ' O ' ' A' ' 408' ' ' HOH . 65.3 Cg_endo . . . . . 0 C--O 1.264 1.782 0 CA-C-O 115.183 -2.091 . . . . 25.6 113.762 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -178.66 152.83 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 120.786 1.63 . . . . 24.93 110.359 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -142.48 133.79 26.25 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 125.056 1.472 . . . . 25.4 113.895 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' SER . . . . . 0.798 ' O ' ' O ' ' B' ' 409' ' ' HOH . 13.2 m -90.15 160.05 16.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.334 1.854 . . . . 20.39 107.11 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . 0.551 ' O ' ' NH1' ' A' ' 87' ' ' ARG 0.422 0.0 OUTLIER -101.77 13.24 35.43 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.006 1.113 . . . . 16.76 114.006 179.4 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -58.68 -46.43 87.26 Favored 'General case' 0 C--O 1.248 1.005 0 C-N-CA 129.574 3.15 . . . . 17.81 108.025 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -118.24 156.66 28.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 109.645 -3.434 . . . . 17.38 108.972 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -57.36 131.86 81.27 Favored Pre-proline 0 CA--C 1.512 -0.513 0 O-C-N 125.922 2.014 . . . . 12.37 106.615 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -76.4 74.66 4.61 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 O-C-N 126.537 2.862 . . . . 10.14 109.074 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 19.1 t -99.4 125.95 52.84 Favored 'Isoleucine or valine' 0 C--O 1.278 2.569 0 C-N-CA 126.53 1.932 . . . . 12.97 113.638 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . 0.547 ' N ' ' O ' ' B' ' 22' ' ' VAL 0.331 0.3 OUTLIER -125.76 160.66 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 128.03 3.331 . . . . 11.56 116.868 -178.452 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 33.4 m -94.63 112.65 24.4 Favored 'General case' 0 C--O 1.254 1.333 0 O-C-N 119.585 -1.947 . . . . 13.4 109.496 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -111.2 170.1 8.34 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 126.812 2.045 . . . . 15.06 109.687 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' TYR . . . . . 0.551 ' CD2' ' O ' ' B' ' 17' ' ' GLY . 3.7 m-85 -140.45 103.41 4.55 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 116.471 -1.728 . . . . 17.57 108.541 -178.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 58.5 mt -101.42 95.58 4.08 Favored 'Isoleucine or valine' 0 C--O 1.266 1.951 0 O-C-N 125.463 1.727 . . . . 17.84 109.979 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . 0.412 1.9 mp0 56.19 59.06 3.89 Favored 'General case' 0 C--O 1.271 2.206 0 O-C-N 128.204 3.44 . . . . 17.44 107.25 -177.165 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' B' ' 14' ' ' TYR . . . 98.33 -52.59 1.2 Allowed Glycine 0 C--O 1.248 1.029 1 O-C-N 129.298 4.124 . . . . 15.35 115.786 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -71.25 111.22 9.31 Favored Pre-proline 0 C--O 1.25 1.127 0 N-CA-C 117.61 2.448 . . . . 17.38 117.61 -176.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -73.64 144.13 35.08 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 C-N-CA 123.775 2.984 . . . . 12.92 112.116 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 12.5 m -157.18 148.81 10.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 127.535 3.022 . . . . 11.73 113.625 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -83.84 112.49 20.17 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 128.088 2.555 . . . . 15.2 108.819 175.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . 0.547 ' O ' ' N ' ' B' ' 11' ' ' VAL . 21.3 m -116.2 143.8 25.4 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 O-C-N 126.523 2.389 . . . . 7.08 113.856 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 46.2 tp -93.41 125.19 37.89 Favored 'General case' 0 C--O 1.264 1.84 0 CA-C-O 116.024 -1.941 . . . . 4.92 108.845 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.3 mt -78.01 109.18 11.85 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 104.957 -2.238 . . . . 6.52 104.957 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ASP . . . . . 0.465 ' OD2' ' OB1' ' B' ' 100' ' ' 1ZK . 58.4 t0 -125.87 107.68 10.72 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 118.365 2.728 . . . . 9.57 118.365 -174.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 76.3 p -72.2 -1.85 16.61 Favored 'General case' 0 C--O 1.247 0.96 0 O-C-N 125.116 1.51 . . . . 11.79 111.24 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.27 2.38 57.75 Favored Glycine 0 C--N 1.3 -1.444 0 C-N-CA 126.338 1.923 . . . . 7.74 116.565 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.55 133.14 56.02 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 128.732 2.813 . . . . 7.89 110.454 -179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.72 -33.74 60.32 Favored 'General case' 0 C--N 1.286 -2.192 0 O-C-N 126.193 2.183 . . . . 11.14 110.386 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -121.82 167.44 13.0 Favored 'General case' 0 C--N 1.294 -1.842 1 C-N-CA 137.328 6.251 . . . . 12.75 115.737 -177.291 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.5 m -111.18 133.19 53.72 Favored 'General case' 0 C--O 1.253 1.274 1 O-C-N 130.268 4.73 . . . . 10.84 110.759 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.75 134.63 60.04 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 O-C-N 126.38 2.3 . . . . 10.52 114.938 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -137.2 163.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-O 121.584 0.707 . . . . 13.33 112.409 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.78 161.85 34.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.828 -1.915 . . . . 15.1 105.828 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLY . . . . . 0.451 ' O ' ' CD1' ' B' ' 36' ' ' ILE . . . 61.27 58.93 11.03 Favored Glycine 0 C--N 1.302 -1.33 0 O-C-N 127.715 3.134 . . . . 19.81 109.651 179.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ILE . . . . . 0.451 ' CD1' ' O ' ' B' ' 35' ' ' GLY . 5.4 mm -155.45 123.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 N-CA-C 103.323 -2.843 . . . . 21.68 103.323 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . -96.91 85.93 3.89 Favored 'General case' 0 C--O 1.259 1.572 0 CA-C-O 113.137 -3.316 . . . . 23.05 113.156 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 75.7 mt -70.39 -33.54 71.5 Favored 'General case' 0 C--O 1.282 2.775 0 N-CA-C 120.479 3.511 . . . . 21.83 120.479 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.66 179.86 16.78 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 124.182 3.173 . . . . 20.25 110.668 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -100.06 37.34 1.66 Allowed 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 118.016 0.908 . . . . 23.1 110.421 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . 0.319 . . -111.6 57.98 0.63 Allowed 'General case' 0 C--O 1.263 1.79 0 C-N-CA 130.076 3.35 . . . . 20.9 112.409 -178.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -137.19 173.47 11.66 Favored 'General case' 0 C--O 1.247 0.96 0 N-CA-C 120.044 3.349 . . . . 18.79 120.044 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' SER . . . . . 0.566 ' O ' ' N ' ' B' ' 58' ' ' GLU . 5.7 m -129.24 133.17 24.86 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 102.782 -3.044 . . . . 18.43 102.782 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -85.37 152.24 10.57 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 127.069 3.141 . . . . 17.45 112.676 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . 0.429 ' O ' ' N ' ' B' ' 56' ' ' THR . 0.0 OUTLIER -167.77 157.53 10.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.267 1.951 . . . . 17.9 116.267 178.761 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ILE . . . . . . . . . . . . . 6.6 pt -99.0 97.05 5.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.039 0 O-C-N 128.656 3.723 . . . . 20.39 116.297 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -100.97 147.21 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 105.755 -1.942 . . . . 20.59 105.755 177.284 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -123.84 164.56 17.0 Favored Glycine 0 C--N 1.312 -0.788 0 CA-C-O 117.532 -1.704 . . . . 18.8 116.004 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -172.63 -153.62 9.55 Favored Glycine 0 N--CA 1.479 1.539 0 O-C-N 126.46 1.918 . . . . 19.27 111.583 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -67.87 128.77 31.76 Favored 'Isoleucine or valine' 0 C--O 1.262 1.759 0 CA-C-N 118.833 1.317 . . . . 19.86 109.242 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 96.47 -9.4 66.88 Favored Glycine 0 N--CA 1.468 0.824 0 CA-C-O 123.037 1.354 . . . . 18.05 116.197 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLY . . . . . . . . . . . . . . . 116.85 -150.03 18.63 Favored Glycine 0 C--N 1.295 -1.713 0 C-N-CA 130.365 3.841 . . . . 18.82 115.225 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -99.29 159.56 14.91 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 110.927 -2.637 . . . . 20.04 117.52 -178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 32.3 pt -148.32 159.31 7.22 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 N-CA-C 102.309 -3.219 . . . . 16.06 102.309 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . 0.286 11.6 m-80 -101.51 146.19 27.99 Favored 'General case' 0 C--N 1.291 -1.959 2 O-C-N 130.483 4.864 . . . . 15.81 107.356 179.81 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . 0.429 ' N ' ' O ' ' B' ' 45' ' ' LYS . 0.9 OUTLIER -145.46 162.93 36.19 Favored 'General case' 0 C--O 1.257 1.458 1 O-C-N 129.202 4.064 . . . . 13.25 113.424 -179.879 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.4 mt -103.04 124.68 48.98 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 102.517 -3.142 . . . . 14.19 102.517 175.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLU . . . . . 0.566 ' N ' ' O ' ' B' ' 43' ' ' SER . 19.1 tt0 -96.12 130.57 43.12 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 127.464 2.977 . . . . 17.21 109.698 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -127.19 104.4 7.94 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 126.561 1.944 . . . . 18.2 115.356 -178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -78.31 150.33 33.33 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 126.839 2.056 . . . . 23.21 114.415 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASN . . . . . 0.503 ' ND2' ' CD ' ' B' ' 72' ' ' ARG . 1.4 t-20 63.97 20.96 12.44 Favored 'General case' 0 C--N 1.302 -1.494 1 C-N-CA 132.67 4.388 . . . . 21.79 119.438 176.717 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 94.1 t -61.58 151.85 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-O 114.402 -2.713 . . . . 19.72 107.931 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.96 139.54 39.52 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 124.358 2.028 . . . . 23.71 109.276 179.494 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . 0.273 7.1 mt -133.17 155.15 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 113.675 -1.602 . . . . 18.02 110.521 -179.077 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . . . -142.99 119.86 11.26 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 103.773 -2.677 . . . . 18.24 103.773 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.42 129.27 6.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.408 0 C-N-CA 130.385 3.474 . . . . 19.84 112.462 -177.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 69.6 mt 56.94 38.05 29.16 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 125.939 2.024 . . . . 20.38 113.187 175.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 m120 62.19 37.03 14.6 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 112.948 -3.406 . . . . 20.53 113.698 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . 0.261 13.8 mptt -137.27 147.3 45.62 Favored 'General case' 0 C--N 1.298 -1.663 1 CA-C-O 111.162 -4.256 . . . . 23.15 100.832 178.255 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.98 136.98 52.53 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 128.126 3.391 . . . . 19.07 103.026 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . . . -145.72 169.88 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-O 112.672 -3.537 . . . . 16.67 107.963 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ARG . . . . . 0.503 ' CD ' ' ND2' ' B' ' 61' ' ' ASN . 6.0 mmt180 -127.61 126.68 42.49 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 113.851 -2.976 . . . . 15.48 105.727 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -162.07 166.1 26.3 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 127.445 2.966 . . . . 13.57 116.44 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.3 m -65.83 144.59 56.74 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 126.954 3.264 . . . . 12.35 109.457 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mt -145.78 129.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 113.566 -3.112 . . . . 15.49 105.534 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' MET . . . . . . . . . . . . . 53.7 mtt -101.58 147.01 26.91 Favored 'General case' 0 C--N 1.31 -1.149 1 O-C-N 131.9 5.75 . . . . 20.48 108.662 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 15.1 m -116.87 138.27 51.63 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 115.394 -2.241 . . . . 15.25 105.904 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.58 178.86 41.03 Favored Glycine 0 C--O 1.244 0.752 0 CA-C-O 124.812 2.34 . . . . 17.16 113.758 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -69.26 66.95 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.649 2.092 . . . . 18.06 116.649 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 7.3 t -102.83 134.06 20.06 Favored Pre-proline 0 C--O 1.259 1.572 0 N-CA-C 101.073 -3.677 . . . . 17.18 101.073 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.53 -13.6 27.54 Favored 'Trans proline' 0 C--O 1.268 1.991 0 C-N-CA 123.906 3.071 . . . . 15.78 116.327 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . 0.371 3.9 tp -147.17 134.94 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 110.661 -2.972 . . . . 14.13 104.218 -178.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -68.11 138.14 55.5 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 114.937 -2.459 . . . . 12.08 105.347 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 77.9 mt -123.18 133.41 69.19 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 127.68 3.113 . . . . 11.0 117.044 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -114.87 102.67 10.2 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 103.871 -2.64 . . . . 12.58 103.871 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . -89.02 -173.57 46.52 Favored Glycine 0 C--N 1.289 -2.031 0 O-C-N 128.019 3.324 . . . . 7.72 111.957 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 24.6 mtm105 -59.18 -21.32 59.25 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 113.383 -3.198 . . . . 10.6 115.46 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -68.79 -40.65 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 127.302 2.876 . . . . 12.15 107.251 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 62.0 mt -81.31 -28.45 10.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.264 0 O-C-N 125.603 1.815 . . . . 9.96 113.741 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.43 -47.07 77.46 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 120.576 1.534 . . . . 11.2 112.004 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 31.4 p -68.5 -19.8 64.55 Favored 'General case' 0 C--O 1.242 0.695 0 O-C-N 127.041 2.713 . . . . 10.96 110.969 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.33 -20.39 57.31 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 116.775 -3.703 . . . . 11.98 110.148 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 9.2 mt -107.17 -6.54 17.27 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.584 1.154 . . . . 10.9 113.083 -179.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 44.02 27.66 Favored Glycine 0 C--N 1.292 -1.877 0 C-N-CA 129.766 3.555 . . . . 11.84 114.504 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' MET . . . . . . . . . . . . . 2.4 ttt -93.76 152.93 18.59 Favored 'General case' 0 C--O 1.267 2.024 0 N-CA-C 108.017 -1.105 . . . . 15.0 108.017 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 84.1 p -147.44 165.1 31.26 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-O 112.826 -3.464 . . . . 14.5 103.501 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . 0.32 0.0 OUTLIER -101.61 132.8 47.09 Favored 'General case' 0 C--N 1.286 -2.185 2 O-C-N 130.353 4.783 . . . . 16.42 100.507 175.741 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -128.26 171.85 11.59 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-N 125.583 3.811 . . . . 21.25 108.468 179.651 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . 0.474 ' CD2' ' CD1' ' A' ' 67' ' ' LEU 0.279 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.501 1 CA-C-O 111.208 -4.234 . . . . 19.4 108.896 178.953 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' 1ZK . . . . . 0.575 ' OH ' ' OD2' ' A' ' 25' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . 0.713 ' O ' ' N ' ' B' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 409' ' ' HOH . . . . . 0.798 ' O ' ' O ' ' B' ' 4' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' PRO . . . . . 0.778 ' HD2' ' HB3' ' B' ' 99' ' ' LEU . 4.5 Cg_endo . . . . . 0 CA--C 1.54 0.797 0 N-CA-C 117.041 1.9 . . . . 26.73 117.041 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . 0.28 1.4 tp60 -89.94 157.96 17.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 103.335 -2.839 . . . . 27.91 103.335 176.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 97' ' ' LEU . 3.0 m-85 -137.73 116.53 12.28 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.214 -2.266 . . . . 23.16 110.822 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . 0.436 ' HB3' ' HD1' ' A' ' 6' ' ' TRP . 3.1 m -81.79 146.22 30.04 Favored 'General case' 0 C--O 1.272 2.271 1 N-CA-C 100.036 -4.061 . . . . 19.66 100.036 178.778 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.432 72.6 mt -104.49 15.56 27.88 Favored 'General case' 0 N--CA 1.489 1.503 1 O-C-N 133.202 6.564 . . . . 15.79 107.898 179.163 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TRP . . . . . 0.436 ' HD1' ' HB3' ' A' ' 4' ' ' SER . 88.1 m95 -65.6 -33.47 75.98 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 126.359 2.98 . . . . 16.99 110.863 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -118.55 158.49 25.31 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-N 110.693 -2.958 . . . . 15.01 103.926 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -67.72 125.25 91.04 Favored Pre-proline 0 N--CA 1.485 1.314 0 CA-C-O 114.167 -2.825 . . . . 14.77 105.767 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -66.49 55.01 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 128.107 3.688 . . . . 14.15 117.007 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.41 125.14 40.1 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 C-N-CA 129.961 3.304 . . . . 18.33 110.07 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.56 HG21 HD21 ' A' ' 67' ' ' LEU 0.284 0.3 OUTLIER -127.82 166.65 24.36 Favored 'Isoleucine or valine' 0 C--O 1.26 1.641 0 N-CA-C 102.165 -3.272 . . . . 19.06 102.165 -179.115 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.47 129.28 48.93 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 115.998 -1.953 . . . . 20.97 113.081 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' A' ' 20' ' ' VAL . . . -120.28 160.21 23.45 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.709 1.595 . . . . 22.17 112.834 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -108.1 102.81 11.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 114.14 -2.838 . . . . 23.43 107.166 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . 0.481 ' N ' ' O ' ' A' ' 18' ' ' GLN 0.251 64.7 mt -91.69 89.45 2.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 C-N-CA 116.704 -1.998 . . . . 26.62 108.111 -179.411 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 56.77 71.73 0.55 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 111.099 -2.773 . . . . 29.41 109.929 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.0 -31.88 1.76 Allowed Glycine 0 C--O 1.254 1.362 0 O-C-N 126.782 2.551 . . . . 25.86 111.951 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.0 mt-30 -81.69 113.96 46.43 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 127.175 2.338 . . . . 23.84 112.68 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . 0.509 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.6 Cg_exo -72.13 139.65 32.92 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 123.459 2.773 . . . . 22.64 109.053 179.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' ' N ' ' A' ' 13' ' ' ALA 0.253 1.2 t -158.38 146.25 8.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 O-C-N 125.148 1.53 . . . . 20.33 112.969 -179.702 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -95.15 128.78 42.25 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 107.448 -1.315 . . . . 17.44 107.448 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.3 m -131.97 156.32 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 125.657 1.848 . . . . 13.61 111.796 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -102.33 129.44 48.78 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 123.34 1.543 . . . . 8.73 108.645 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' LEU . 2.6 mp -78.51 102.69 8.01 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 104.096 -2.557 . . . . 8.91 104.096 176.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . 0.575 ' OD2' ' OH ' ' B' ' 100' ' ' 1ZK . 43.8 t0 -119.25 105.65 11.55 Favored 'General case' 0 C--O 1.257 1.448 0 N-CA-C 116.127 1.899 . . . . 9.03 116.127 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.9 p -73.31 10.67 0.93 Allowed 'General case' 0 C--N 1.299 -1.629 0 O-C-N 126.69 2.494 . . . . 5.87 114.928 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . 0.655 ' O ' " HA'" ' B' ' 100' ' ' 1ZK . . . -129.27 24.49 4.71 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 125.278 1.418 . . . . 5.78 114.009 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.623 ' HA ' HG25 ' B' ' 100' ' ' 1ZK . . . -123.46 129.94 51.98 Favored 'General case' 0 C--O 1.259 1.563 1 C-N-CA 134.314 5.046 . . . . 7.45 108.95 178.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -84.45 -31.66 24.47 Favored 'General case' 0 C--O 1.278 2.555 0 N-CA-C 105.244 -2.132 . . . . 13.61 105.244 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -128.12 167.95 16.07 Favored 'General case' 0 C--O 1.261 1.684 0 N-CA-C 119.222 3.045 . . . . 14.81 119.222 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.8 127.42 54.0 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-N 112.915 -1.948 . . . . 13.35 111.551 -177.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . 0.525 ' CD1' HG21 ' A' ' 47' ' ' VAL . 11.3 mt -127.19 120.56 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 127.241 2.838 . . . . 14.23 109.32 -178.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.59 136.93 55.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.773 0 O-C-N 128.273 3.483 . . . . 17.41 106.267 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.76 -179.18 7.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 103.999 -2.593 . . . . 20.44 103.999 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -5.79 76.17 0.0 OUTLIER Glycine 0 N--CA 1.406 -3.305 1 N-CA-C 124.841 4.696 . . . . 24.47 124.841 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . 0.504 HD12 HD21 ' A' ' 38' ' ' LEU . 6.6 pt -135.55 150.75 29.15 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 131.693 3.997 . . . . 25.94 100.431 176.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -108.4 118.69 37.42 Favored 'General case' 0 C--N 1.317 -0.848 0 O-C-N 128.579 3.674 . . . . 27.38 108.687 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.504 HD21 HD12 ' A' ' 36' ' ' ILE . 12.7 mt -116.08 -4.51 11.97 Favored 'General case' 0 C--O 1.259 1.604 0 C-N-CA 127.363 2.265 . . . . 24.62 115.901 -177.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.15 -130.98 9.46 Favored Glycine 0 CA--C 1.483 -1.956 1 N-CA-C 130.309 6.883 . . . . 26.43 130.309 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -130.8 -23.34 2.54 Favored 'General case' 0 C--O 1.272 2.276 1 N-CA-C 122.756 4.354 . . . . 28.97 122.756 -177.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -82.47 66.27 7.99 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 124.554 1.158 . . . . 28.04 109.204 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . 0.414 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 37.0 p90 -118.36 158.5 25.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 126.595 3.093 . . . . 24.16 112.725 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . . . -138.08 127.35 14.78 Favored Pre-proline 0 C--N 1.297 -1.688 1 C-N-CA 132.59 4.356 . . . . 21.65 104.691 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -76.63 137.1 17.86 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 O-C-N 125.426 2.277 . . . . 19.54 107.932 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.639 ' O ' ' N ' ' A' ' 56' ' ' THR 0.273 72.3 mmtt -138.28 162.9 33.16 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 126.252 2.22 . . . . 21.36 109.3 176.153 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 5.9 pt -120.51 139.53 47.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 N-CA-C 105.413 -2.069 . . . . 17.67 105.413 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . 0.525 HG21 ' CD1' ' A' ' 32' ' ' ILE . 5.9 m -117.32 157.55 18.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 125.638 2.637 . . . . 14.57 108.199 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.77 157.15 20.92 Favored Glycine 0 CA--C 1.54 1.654 1 C-N-CA 131.695 4.474 . . . . 15.04 114.776 178.828 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -167.08 -164.87 23.51 Favored Glycine 0 C--O 1.254 1.378 1 CA-C-O 111.474 -5.07 . . . . 18.37 109.959 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . 0.512 HD11 ' N ' ' B' ' 49' ' ' GLY 0.332 2.7 pp -58.19 -37.27 61.47 Favored 'Isoleucine or valine' 0 C--O 1.277 2.526 1 CA-C-N 124.704 4.252 . . . . 16.46 120.844 -179.381 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . 0.506 ' HA3' ' N ' ' B' ' 52' ' ' GLY . . . -82.93 -18.24 65.74 Favored Glycine 0 N--CA 1.493 2.454 0 CA-C-O 126.243 3.135 . . . . 15.7 113.997 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' N ' ' HA3' ' B' ' 51' ' ' GLY . . . 154.31 -135.24 4.64 Favored Glycine 0 C--N 1.301 -1.409 0 O-C-N 117.088 -3.596 . . . . 14.67 112.162 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . 0.446 ' HA ' ' O ' ' A' ' 47' ' ' VAL . 53.8 m-85 -123.62 135.67 54.07 Favored 'General case' 0 C--N 1.314 -0.948 1 C-N-CA 133.458 4.703 . . . . 17.87 115.907 -175.39 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.6 mt -115.88 158.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 O-C-N 127.883 3.24 . . . . 16.85 109.904 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -96.91 138.4 34.51 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 103.617 -2.734 . . . . 19.86 103.617 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . 0.639 ' N ' ' O ' ' A' ' 45' ' ' LYS . 78.7 p -134.52 170.9 15.07 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.876 1.985 . . . . 16.97 110.045 179.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . -120.78 104.25 9.74 Favored 'General case' 0 N--CA 1.44 -0.969 1 C-N-CA 132.738 4.415 . . . . 18.08 108.55 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.531 ' OE1' HG23 ' A' ' 74' ' ' THR . 0.2 OUTLIER -89.48 122.08 32.32 Favored 'General case' 0 C--O 1.256 1.43 0 O-C-N 127.262 2.851 . . . . 20.71 113.329 -179.687 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -119.45 141.39 49.18 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 105.223 -2.14 . . . . 19.6 105.223 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -106.19 165.45 11.22 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 125.388 2.518 . . . . 21.07 112.492 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . . . 26.78 50.54 0.02 OUTLIER 'General case' 0 C--O 1.253 1.245 0 CA-C-N 111.121 -2.763 . . . . 23.68 113.113 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 0.595 ' O ' ' HA ' ' A' ' 72' ' ' ARG 0.306 0.9 OUTLIER -79.52 153.14 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 116.341 -2.143 . . . . 23.38 105.497 179.822 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.695 ' OE1' ' NZ ' ' A' ' 70' ' ' LYS 0.335 30.8 mt-10 -89.86 136.6 32.95 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 121.846 2.112 . . . . 26.9 110.263 179.34 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 10.8 mt -137.68 137.28 45.48 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 125.235 1.414 . . . . 21.86 114.219 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -125.56 124.86 42.2 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 106.096 -1.816 . . . . 25.84 106.096 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.0 p -151.12 142.94 16.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 105.437 -2.06 . . . . 21.41 105.437 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.906 HD13 HD23 ' B' ' 99' ' ' LEU . 62.9 mt 53.59 36.21 22.93 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.799 -1.926 . . . . 23.84 105.799 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.275 51.7 t-20 57.15 30.25 17.99 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 112.0 -2.363 . . . . 27.21 113.161 176.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.08 155.44 43.28 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 126.347 2.279 . . . . 28.63 107.401 -178.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.824 ' O ' HG23 ' A' ' 71' ' ' VAL . 10.4 mmmt -105.68 155.12 19.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 N-CA-C 119.532 3.16 . . . . 28.4 119.532 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 70' ' ' LYS . 4.4 t -171.01 155.39 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.83 0 CA-C-O 123.452 1.596 . . . . 23.33 110.554 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HA ' ' O ' ' A' ' 62' ' ' VAL . 4.9 ttt180 -123.63 121.99 36.99 Favored 'General case' 0 C--O 1.27 2.17 1 N-CA-C 100.153 -4.017 . . . . 29.77 100.153 177.273 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.77 159.33 29.91 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 113.865 -2.969 . . . . 19.97 111.44 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . 0.531 HG23 ' OE1' ' A' ' 58' ' ' GLU . 1.9 m -55.37 132.41 48.06 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 124.031 3.105 . . . . 17.3 115.852 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.531 ' HB ' HG11 ' A' ' 62' ' ' VAL . 2.6 mm -123.19 123.9 68.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 O-C-N 117.714 -3.116 . . . . 15.93 111.697 176.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -107.08 121.57 44.75 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 127.006 2.692 . . . . 21.19 109.65 -178.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -95.44 149.08 21.78 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 125.591 3.814 . . . . 19.05 111.837 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.42 179.37 45.92 Favored Glycine 0 N--CA 1.476 1.304 0 CA-C-O 125.705 2.836 . . . . 20.7 119.343 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -87.34 69.14 9.93 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 128.308 2.643 . . . . 24.91 115.065 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.54 132.29 21.02 Favored Pre-proline 0 C--N 1.318 -0.796 0 C-N-CA 131.307 3.843 . . . . 20.7 110.348 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HG2' HE13 ' B' ' 100' ' ' 1ZK . 5.6 Cg_exo -59.11 -31.57 95.74 Favored 'Trans proline' 0 C--O 1.255 1.347 0 O-C-N 124.695 1.892 . . . . 19.78 109.949 177.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . 0.701 HD11 ' H3 ' ' B' ' 100' ' ' 1ZK . 19.6 mt -139.95 152.76 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 117.417 -1.713 . . . . 17.96 109.196 -178.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.95 116.02 19.86 Favored 'General case' 0 CA--C 1.561 1.377 0 O-C-N 128.221 3.451 . . . . 14.21 104.114 178.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 10.2 pt -102.82 135.59 39.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 115.026 -2.416 . . . . 12.08 109.817 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 1.1 m-30 -113.39 99.24 7.63 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 127.177 2.798 . . . . 10.97 105.372 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.68 -172.28 48.04 Favored Glycine 0 CA--C 1.49 -1.527 0 N-CA-C 119.169 2.427 . . . . 10.3 119.169 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . 0.415 ' NH1' ' O ' ' B' ' 5' ' ' LEU . 41.3 mtm105 -55.57 -27.06 46.95 Favored 'General case' 0 C--O 1.28 2.669 0 N-CA-C 119.127 3.01 . . . . 11.11 119.127 -176.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' N ' ' OD1' ' A' ' 88' ' ' ASN . 21.6 p-10 -62.64 -35.36 79.35 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 124.955 1.409 . . . . 13.83 111.108 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 6.4 mt -90.74 -36.98 8.77 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 C-N-CA 126.239 1.816 . . . . 14.09 109.774 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.75 -32.83 67.85 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 120.241 -0.584 . . . . 12.76 109.88 178.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -78.85 -31.92 45.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 118.328 -2.732 . . . . 12.86 112.886 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.19 91.95 Favored 'General case' 0 C--O 1.254 1.336 0 C-N-CA 128.448 2.699 . . . . 14.01 107.989 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.6 mt -81.13 -16.34 53.3 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.636 -1.62 . . . . 15.24 114.113 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.7 26.92 48.76 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 127.768 2.604 . . . . 15.7 112.946 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmm -73.63 156.9 37.53 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 126.764 2.025 . . . . 18.09 108.13 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 83.0 p -148.92 171.68 15.93 Favored 'General case' 0 N--CA 1.487 1.392 1 O-C-N 129.476 4.235 . . . . 16.81 109.757 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.4 mt -119.01 129.08 54.95 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 102.924 -2.991 . . . . 18.09 102.924 177.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . 0.531 ' O ' ' HA ' ' B' ' 95' ' ' MET . 3.0 m-80 -124.28 144.65 49.86 Favored 'General case' 0 C--O 1.251 1.175 0 O-C-N 127.406 2.941 . . . . 21.77 108.152 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.256 1.409 0 CA-C-O 126.336 2.969 . . . . 19.13 113.58 177.149 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PRO . . . . . 0.713 ' N ' ' O ' ' A' ' 408' ' ' HOH . 65.3 Cg_endo . . . . . 0 C--O 1.264 1.782 0 CA-C-O 115.183 -2.091 . . . . 25.6 113.762 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -178.66 152.83 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 120.786 1.63 . . . . 24.93 110.359 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -142.48 133.79 26.25 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 125.056 1.472 . . . . 25.4 113.895 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' SER . . . . . 0.798 ' O ' ' O ' ' B' ' 409' ' ' HOH . 13.2 m -90.15 160.05 16.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.334 1.854 . . . . 20.39 107.11 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . 0.415 ' O ' ' NH1' ' A' ' 87' ' ' ARG 0.422 0.0 OUTLIER -101.77 13.24 35.43 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.006 1.113 . . . . 16.76 114.006 179.4 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -58.68 -46.43 87.26 Favored 'General case' 0 C--O 1.248 1.005 0 C-N-CA 129.574 3.15 . . . . 17.81 108.025 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -118.24 156.66 28.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 109.645 -3.434 . . . . 17.38 108.972 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -57.36 131.86 81.27 Favored Pre-proline 0 CA--C 1.512 -0.513 0 O-C-N 125.922 2.014 . . . . 12.37 106.615 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -76.4 74.66 4.61 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 O-C-N 126.537 2.862 . . . . 10.14 109.074 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 19.1 t -99.4 125.95 52.84 Favored 'Isoleucine or valine' 0 C--O 1.278 2.569 0 C-N-CA 126.53 1.932 . . . . 12.97 113.638 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . 0.509 HG21 HD21 ' B' ' 67' ' ' LEU 0.331 0.3 OUTLIER -125.76 160.66 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 128.03 3.331 . . . . 11.56 116.868 -178.452 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 33.4 m -94.63 112.65 24.4 Favored 'General case' 0 C--O 1.254 1.333 0 O-C-N 119.585 -1.947 . . . . 13.4 109.496 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . 0.448 ' HB2' ' CG1' ' B' ' 66' ' ' VAL . . . -111.2 170.1 8.34 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 126.812 2.045 . . . . 15.06 109.687 -179.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' TYR . . . . . 0.551 ' CD2' ' O ' ' B' ' 17' ' ' GLY . 3.7 m-85 -140.45 103.41 4.55 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 116.471 -1.728 . . . . 17.57 108.541 -178.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 58.5 mt -101.42 95.58 4.08 Favored 'Isoleucine or valine' 0 C--O 1.266 1.951 0 O-C-N 125.463 1.727 . . . . 17.84 109.979 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . 0.412 1.9 mp0 56.19 59.06 3.89 Favored 'General case' 0 C--O 1.271 2.206 0 O-C-N 128.204 3.44 . . . . 17.44 107.25 -177.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' B' ' 14' ' ' TYR . . . 98.33 -52.59 1.2 Allowed Glycine 0 C--O 1.248 1.029 1 O-C-N 129.298 4.124 . . . . 15.35 115.786 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -71.25 111.22 9.31 Favored Pre-proline 0 C--O 1.25 1.127 0 N-CA-C 117.61 2.448 . . . . 17.38 117.61 -176.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' B' ' 13' ' ' ALA . 90.2 Cg_endo -73.64 144.13 35.08 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 C-N-CA 123.775 2.984 . . . . 12.92 112.116 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 12.5 m -157.18 148.81 10.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 127.535 3.022 . . . . 11.73 113.625 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 440' ' ' HOH . 43.6 mt-10 -83.84 112.49 20.17 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 128.088 2.555 . . . . 15.2 108.819 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . 0.419 ' O ' ' N ' ' B' ' 11' ' ' VAL . 21.3 m -116.2 143.8 25.4 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 O-C-N 126.523 2.389 . . . . 7.08 113.856 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 46.2 tp -93.41 125.19 37.89 Favored 'General case' 0 C--O 1.264 1.84 0 CA-C-O 116.024 -1.941 . . . . 4.92 108.845 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.3 mt -78.01 109.18 11.85 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 104.957 -2.238 . . . . 6.52 104.957 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ASP . . . . . 0.465 ' OD2' ' OB1' ' B' ' 100' ' ' 1ZK . 58.4 t0 -125.87 107.68 10.72 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 118.365 2.728 . . . . 9.57 118.365 -174.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . 0.717 HG21 HD22 ' B' ' 97' ' ' LEU . 76.3 p -72.2 -1.85 16.61 Favored 'General case' 0 C--O 1.247 0.96 0 O-C-N 125.116 1.51 . . . . 11.79 111.24 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.27 2.38 57.75 Favored Glycine 0 C--N 1.3 -1.444 0 C-N-CA 126.338 1.923 . . . . 7.74 116.565 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' B' ' 100' ' ' 1ZK . . . -114.55 133.14 56.02 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 128.732 2.813 . . . . 7.89 110.454 -179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.72 -33.74 60.32 Favored 'General case' 0 C--N 1.286 -2.192 0 O-C-N 126.193 2.183 . . . . 11.14 110.386 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . 0.799 ' HB2' ' HE2' ' B' ' 100' ' ' 1ZK . 37.3 m-20 -121.82 167.44 13.0 Favored 'General case' 0 C--N 1.294 -1.842 1 C-N-CA 137.328 6.251 . . . . 12.75 115.737 -177.291 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.5 m -111.18 133.19 53.72 Favored 'General case' 0 C--O 1.253 1.274 1 O-C-N 130.268 4.73 . . . . 10.84 110.759 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . 0.406 HD11 HG21 ' B' ' 47' ' ' VAL . 1.8 mt -131.75 134.63 60.04 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 O-C-N 126.38 2.3 . . . . 10.52 114.938 179.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -137.2 163.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-O 121.584 0.707 . . . . 13.33 112.409 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.78 161.85 34.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.828 -1.915 . . . . 15.1 105.828 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLY . . . . . 0.557 ' O ' HD13 ' B' ' 36' ' ' ILE . . . 61.27 58.93 11.03 Favored Glycine 0 C--N 1.302 -1.33 0 O-C-N 127.715 3.134 . . . . 19.81 109.651 179.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ILE . . . . . 0.557 HD13 ' O ' ' B' ' 35' ' ' GLY . 5.4 mm -155.45 123.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 N-CA-C 103.323 -2.843 . . . . 21.68 103.323 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . -96.91 85.93 3.89 Favored 'General case' 0 C--O 1.259 1.572 0 CA-C-O 113.137 -3.316 . . . . 23.05 113.156 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . 0.434 HD12 ' CD2' ' B' ' 59' ' ' TYR . 75.7 mt -70.39 -33.54 71.5 Favored 'General case' 0 C--O 1.282 2.775 0 N-CA-C 120.479 3.511 . . . . 21.83 120.479 -178.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.66 179.86 16.78 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 124.182 3.173 . . . . 20.25 110.668 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -100.06 37.34 1.66 Allowed 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 118.016 0.908 . . . . 23.1 110.421 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . 0.319 . . -111.6 57.98 0.63 Allowed 'General case' 0 C--O 1.263 1.79 0 C-N-CA 130.076 3.35 . . . . 20.9 112.409 -178.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -137.19 173.47 11.66 Favored 'General case' 0 C--O 1.247 0.96 0 N-CA-C 120.044 3.349 . . . . 18.79 120.044 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' SER . . . . . 0.428 ' O ' ' N ' ' B' ' 58' ' ' GLU . 5.7 m -129.24 133.17 24.86 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 102.782 -3.044 . . . . 18.43 102.782 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -85.37 152.24 10.57 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 127.069 3.141 . . . . 17.45 112.676 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . 0.688 ' HD2' ' HB2' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -167.77 157.53 10.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.267 1.951 . . . . 17.9 116.267 178.761 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ILE . . . . . 0.524 ' O ' HG13 ' B' ' 46' ' ' ILE . 6.6 pt -99.0 97.05 5.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.039 0 O-C-N 128.656 3.723 . . . . 20.39 116.297 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 47' ' ' VAL . . . . . 0.486 HG23 ' ND1' ' B' ' 100' ' ' 1ZK . 0.2 OUTLIER -100.97 147.21 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 105.755 -1.942 . . . . 20.59 105.755 177.284 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLY . . . . . 0.617 ' HA3' ' CE1' ' B' ' 53' ' ' PHE . . . -123.84 164.56 17.0 Favored Glycine 0 C--N 1.312 -0.788 0 CA-C-O 117.532 -1.704 . . . . 18.8 116.004 -178.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 50' ' ' ILE . . . -172.63 -153.62 9.55 Favored Glycine 0 N--CA 1.479 1.539 0 O-C-N 126.46 1.918 . . . . 19.27 111.583 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -67.87 128.77 31.76 Favored 'Isoleucine or valine' 0 C--O 1.262 1.759 0 CA-C-N 118.833 1.317 . . . . 19.86 109.242 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . 0.491 ' C ' ' HA3' ' A' ' 51' ' ' GLY . . . 96.47 -9.4 66.88 Favored Glycine 0 N--CA 1.468 0.824 0 CA-C-O 123.037 1.354 . . . . 18.05 116.197 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLY . . . . . 0.506 ' N ' ' HA3' ' A' ' 51' ' ' GLY . . . 116.85 -150.03 18.63 Favored Glycine 0 C--N 1.295 -1.713 0 C-N-CA 130.365 3.841 . . . . 18.82 115.225 178.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' PHE . . . . . 0.617 ' CE1' ' HA3' ' B' ' 48' ' ' GLY . 76.4 m-85 -99.29 159.56 14.91 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 110.927 -2.637 . . . . 20.04 117.52 -178.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 32.3 pt -148.32 159.31 7.22 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 N-CA-C 102.309 -3.219 . . . . 16.06 102.309 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . 0.286 11.6 m-80 -101.51 146.19 27.99 Favored 'General case' 0 C--N 1.291 -1.959 2 O-C-N 130.483 4.864 . . . . 15.81 107.356 179.81 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . 0.401 ' N ' ' O ' ' B' ' 45' ' ' LYS . 0.9 OUTLIER -145.46 162.93 36.19 Favored 'General case' 0 C--O 1.257 1.458 1 O-C-N 129.202 4.064 . . . . 13.25 113.424 -179.879 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.4 mt -103.04 124.68 48.98 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 102.517 -3.142 . . . . 14.19 102.517 175.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLU . . . . . 0.688 ' HB2' ' HD2' ' B' ' 45' ' ' LYS . 19.1 tt0 -96.12 130.57 43.12 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 127.464 2.977 . . . . 17.21 109.698 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . 0.434 ' CD2' HD12 ' B' ' 38' ' ' LEU . 85.0 m-85 -127.19 104.4 7.94 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 126.561 1.944 . . . . 18.2 115.356 -178.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -78.31 150.33 33.33 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 126.839 2.056 . . . . 23.21 114.415 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASN . . . . . 0.78 ' OD1' ' HD2' ' B' ' 72' ' ' ARG . 54.8 t30 63.97 20.96 12.44 Favored 'General case' 0 C--N 1.302 -1.494 1 C-N-CA 132.67 4.388 . . . . 21.79 119.438 176.717 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 94.1 t -61.58 151.85 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-O 114.402 -2.713 . . . . 19.72 107.931 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . 0.522 ' C ' HG13 ' B' ' 64' ' ' ILE . 0.3 OUTLIER -104.96 139.54 39.52 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 124.358 2.028 . . . . 23.71 109.276 179.494 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . 0.522 HG13 ' C ' ' B' ' 63' ' ' GLU 0.273 7.1 mt -133.17 155.15 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 113.675 -1.602 . . . . 18.02 110.521 -179.077 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . . . -142.99 119.86 11.26 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 103.773 -2.677 . . . . 18.24 103.773 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . 0.649 HG23 HD21 ' B' ' 93' ' ' LEU . 0.0 OUTLIER -147.42 129.27 6.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.408 0 C-N-CA 130.385 3.474 . . . . 19.84 112.462 -177.867 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 66' ' ' VAL . 69.6 mt 56.94 38.05 29.16 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 125.939 2.024 . . . . 20.38 113.187 175.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ASN . . . . . 0.505 ' C ' ' HD2' ' B' ' 69' ' ' LYS . 26.2 m120 62.19 37.03 14.6 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 112.948 -3.406 . . . . 20.53 113.698 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . 0.528 ' HB2' HD23 ' B' ' 93' ' ' LEU 0.261 13.8 mptt -137.27 147.3 45.62 Favored 'General case' 0 C--N 1.298 -1.663 1 CA-C-O 111.162 -4.256 . . . . 23.15 100.832 178.255 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.473 ' HE2' ' H ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -114.98 136.98 52.53 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 128.126 3.391 . . . . 19.07 103.026 -179.716 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . . . -145.72 169.88 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-O 112.672 -3.537 . . . . 16.67 107.963 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ARG . . . . . 0.78 ' HD2' ' OD1' ' B' ' 61' ' ' ASN . 6.0 mmt180 -127.61 126.68 42.49 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 113.851 -2.976 . . . . 15.48 105.727 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -162.07 166.1 26.3 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 127.445 2.966 . . . . 13.57 116.44 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.3 m -65.83 144.59 56.74 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 126.954 3.264 . . . . 12.35 109.457 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mt -145.78 129.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 113.566 -3.112 . . . . 15.49 105.534 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' MET . . . . . . . . . . . . . 53.7 mtt -101.58 147.01 26.91 Favored 'General case' 0 C--N 1.31 -1.149 1 O-C-N 131.9 5.75 . . . . 20.48 108.662 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 15.1 m -116.87 138.27 51.63 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 115.394 -2.241 . . . . 15.25 105.904 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.58 178.86 41.03 Favored Glycine 0 C--O 1.244 0.752 0 CA-C-O 124.812 2.34 . . . . 17.16 113.758 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -69.26 66.95 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.649 2.092 . . . . 18.06 116.649 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 7.3 t -102.83 134.06 20.06 Favored Pre-proline 0 C--O 1.259 1.572 0 N-CA-C 101.073 -3.677 . . . . 17.18 101.073 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' PRO . . . . . 0.458 ' HG2' HG22 ' B' ' 82' ' ' ILE . 87.9 Cg_endo -72.53 -13.6 27.54 Favored 'Trans proline' 0 C--O 1.268 1.991 0 C-N-CA 123.906 3.071 . . . . 15.78 116.327 -178.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . 0.458 HG22 ' HG2' ' B' ' 81' ' ' PRO 0.371 3.9 tp -147.17 134.94 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 110.661 -2.972 . . . . 14.13 104.218 -178.537 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -68.11 138.14 55.5 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 114.937 -2.459 . . . . 12.08 105.347 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 77.9 mt -123.18 133.41 69.19 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 127.68 3.113 . . . . 11.0 117.044 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -114.87 102.67 10.2 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 103.871 -2.64 . . . . 12.58 103.871 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . -89.02 -173.57 46.52 Favored Glycine 0 C--N 1.289 -2.031 0 O-C-N 128.019 3.324 . . . . 7.72 111.957 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 24.6 mtm105 -59.18 -21.32 59.25 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 113.383 -3.198 . . . . 10.6 115.46 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -68.79 -40.65 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 127.302 2.876 . . . . 12.15 107.251 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 62.0 mt -81.31 -28.45 10.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.264 0 O-C-N 125.603 1.815 . . . . 9.96 113.741 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.43 -47.07 77.46 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 120.576 1.534 . . . . 11.2 112.004 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 31.4 p -68.5 -19.8 64.55 Favored 'General case' 0 C--O 1.242 0.695 0 O-C-N 127.041 2.713 . . . . 10.96 110.969 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.33 -20.39 57.31 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 116.775 -3.703 . . . . 11.98 110.148 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LEU . . . . . 0.649 HD21 HG23 ' B' ' 66' ' ' VAL . 9.2 mt -107.17 -6.54 17.27 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.584 1.154 . . . . 10.9 113.083 -179.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 44.02 27.66 Favored Glycine 0 C--N 1.292 -1.877 0 C-N-CA 129.766 3.555 . . . . 11.84 114.504 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 98' ' ' ASN . 2.4 ttt -93.76 152.93 18.59 Favored 'General case' 0 C--O 1.267 2.024 0 N-CA-C 108.017 -1.105 . . . . 15.0 108.017 -178.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 84.1 p -147.44 165.1 31.26 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-O 112.826 -3.464 . . . . 14.5 103.501 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LEU . . . . . 0.717 HD22 HG21 ' B' ' 26' ' ' THR 0.32 0.0 OUTLIER -101.61 132.8 47.09 Favored 'General case' 0 C--N 1.286 -2.185 2 O-C-N 130.353 4.783 . . . . 16.42 100.507 175.741 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -128.26 171.85 11.59 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-N 125.583 3.811 . . . . 21.25 108.468 179.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . 0.906 HD23 HD13 ' A' ' 67' ' ' LEU 0.279 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.501 1 CA-C-O 111.208 -4.234 . . . . 19.4 108.896 178.953 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 100' ' ' 1ZK . . . . . 1.136 CD11 HD15 ' B' ' 100' ' ' 1ZK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . 0.713 ' O ' ' N ' ' B' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 409' ' ' HOH . . . . . 0.798 ' O ' ' O ' ' B' ' 4' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 440' ' ' HOH . . . . . 0.451 ' O ' ' HG2' ' B' ' 21' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.778 ' HD2' ' HB3' ' B' ' 99' ' ' LEU . 4.5 Cg_endo . . . . . 0 CA--C 1.54 0.797 0 N-CA-C 117.041 1.9 . . . . 26.73 117.041 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.441 HE21 ' HB2' ' A' ' 2' ' ' GLN 0.28 0.0 OUTLIER -89.94 157.96 17.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 103.335 -2.839 . . . . 27.91 103.335 176.849 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.482 ' HB2' ' O ' ' B' ' 97' ' ' LEU . 3.0 m-85 -137.73 116.53 12.28 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 112.214 -2.266 . . . . 23.16 110.822 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . 0.436 ' HB3' ' HD1' ' A' ' 6' ' ' TRP . 3.1 m -81.79 146.22 30.04 Favored 'General case' 0 C--O 1.272 2.271 1 N-CA-C 100.036 -4.061 . . . . 19.66 100.036 178.778 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . 0.432 72.6 mt -104.49 15.56 27.88 Favored 'General case' 0 N--CA 1.489 1.503 1 O-C-N 133.202 6.564 . . . . 15.79 107.898 179.163 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.436 ' HD1' ' HB3' ' A' ' 4' ' ' SER . 88.1 m95 -65.6 -33.47 75.98 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 126.359 2.98 . . . . 16.99 110.863 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -118.55 158.49 25.31 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-N 110.693 -2.958 . . . . 15.01 103.926 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -67.72 125.25 91.04 Favored Pre-proline 0 N--CA 1.485 1.314 0 CA-C-O 114.167 -2.825 . . . . 14.77 105.767 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -66.49 55.01 0.41 Allowed 'Trans proline' 0 C--N 1.304 -1.782 0 O-C-N 128.107 3.688 . . . . 14.15 117.007 -178.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.41 125.14 40.1 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 C-N-CA 129.961 3.304 . . . . 18.33 110.07 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.56 HG21 HD21 ' A' ' 67' ' ' LEU 0.284 0.3 OUTLIER -127.82 166.65 24.36 Favored 'Isoleucine or valine' 0 C--O 1.26 1.641 0 N-CA-C 102.165 -3.272 . . . . 19.06 102.165 -179.115 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.47 129.28 48.93 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 115.998 -1.953 . . . . 20.97 113.081 -179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' A' ' 20' ' ' VAL . . . -120.28 160.21 23.45 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.709 1.595 . . . . 22.17 112.834 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -108.1 102.81 11.94 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 114.14 -2.838 . . . . 23.43 107.166 176.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.481 ' N ' ' O ' ' A' ' 18' ' ' GLN 0.251 64.7 mt -91.69 89.45 2.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 C-N-CA 116.704 -1.998 . . . . 26.62 108.111 -179.411 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 56.77 71.73 0.55 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 111.099 -2.773 . . . . 29.41 109.929 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.0 -31.88 1.76 Allowed Glycine 0 C--O 1.254 1.362 0 O-C-N 126.782 2.551 . . . . 25.86 111.951 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 15' ' ' ILE . 40.0 mt-30 -81.69 113.96 46.43 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 127.175 2.338 . . . . 23.84 112.68 -179.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.509 ' O ' HG23 ' A' ' 20' ' ' VAL . 12.6 Cg_exo -72.13 139.65 32.92 Favored 'Trans proline' 0 C--O 1.246 0.903 0 C-N-CA 123.459 2.773 . . . . 22.64 109.053 179.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' ' N ' ' A' ' 13' ' ' ALA 0.253 1.2 t -158.38 146.25 8.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 O-C-N 125.148 1.53 . . . . 20.33 112.969 -179.702 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -95.15 128.78 42.25 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 107.448 -1.315 . . . . 17.44 107.448 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.3 m -131.97 156.32 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 125.657 1.848 . . . . 13.61 111.796 -178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -102.33 129.44 48.78 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 123.34 1.543 . . . . 8.73 108.645 178.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.424 ' N ' ' CD1' ' A' ' 24' ' ' LEU . 2.6 mp -78.51 102.69 8.01 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 104.096 -2.557 . . . . 8.91 104.096 176.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.575 ' OD2' ' OH ' ' B' ' 100' ' ' 1ZK . 43.8 t0 -119.25 105.65 11.55 Favored 'General case' 0 C--O 1.257 1.448 0 N-CA-C 116.127 1.899 . . . . 9.03 116.127 -177.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.9 p -73.31 10.67 0.93 Allowed 'General case' 0 C--N 1.299 -1.629 0 O-C-N 126.69 2.494 . . . . 5.87 114.928 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.655 ' O ' " HA'" ' B' ' 100' ' ' 1ZK . . . -129.27 24.49 4.71 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 125.278 1.418 . . . . 5.78 114.009 -178.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.623 ' HA ' HG25 ' B' ' 100' ' ' 1ZK . . . -123.46 129.94 51.98 Favored 'General case' 0 C--O 1.259 1.563 1 C-N-CA 134.314 5.046 . . . . 7.45 108.95 178.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -84.45 -31.66 24.47 Favored 'General case' 0 C--O 1.278 2.555 0 N-CA-C 105.244 -2.132 . . . . 13.61 105.244 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 42.5 m-20 -128.12 167.95 16.07 Favored 'General case' 0 C--O 1.261 1.684 0 N-CA-C 119.222 3.045 . . . . 14.81 119.222 -178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -108.8 127.42 54.0 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-N 112.915 -1.948 . . . . 13.35 111.551 -177.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.525 ' CD1' HG21 ' A' ' 47' ' ' VAL . 11.3 mt -127.19 120.56 55.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 127.241 2.838 . . . . 14.23 109.32 -178.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 77.3 t -119.59 136.93 55.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.773 0 O-C-N 128.273 3.483 . . . . 17.41 106.267 179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.76 -179.18 7.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 103.999 -2.593 . . . . 20.44 103.999 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -5.79 76.17 0.0 OUTLIER Glycine 0 N--CA 1.406 -3.305 1 N-CA-C 124.841 4.696 . . . . 24.47 124.841 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.504 HD12 HD21 ' A' ' 38' ' ' LEU . 6.6 pt -135.55 150.75 29.15 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 131.693 3.997 . . . . 25.94 100.431 176.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -108.4 118.69 37.42 Favored 'General case' 0 C--N 1.317 -0.848 0 O-C-N 128.579 3.674 . . . . 27.38 108.687 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.504 HD21 HD12 ' A' ' 36' ' ' ILE . 12.7 mt -116.08 -4.51 11.97 Favored 'General case' 0 C--O 1.259 1.604 0 C-N-CA 127.363 2.265 . . . . 24.62 115.901 -177.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 115.15 -130.98 9.46 Favored Glycine 0 CA--C 1.483 -1.956 1 N-CA-C 130.309 6.883 . . . . 26.43 130.309 178.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -130.8 -23.34 2.54 Favored 'General case' 0 C--O 1.272 2.276 1 N-CA-C 122.756 4.354 . . . . 28.97 122.756 -177.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -82.47 66.27 7.99 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 124.554 1.158 . . . . 28.04 109.204 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.414 ' CD1' ' C ' ' A' ' 42' ' ' TYR . 37.0 p90 -118.36 158.5 25.13 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 126.595 3.093 . . . . 24.16 112.725 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . . . -138.08 127.35 14.78 Favored Pre-proline 0 C--N 1.297 -1.688 1 C-N-CA 132.59 4.356 . . . . 21.65 104.691 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -76.63 137.1 17.86 Favored 'Trans proline' 0 C--N 1.309 -1.527 0 O-C-N 125.426 2.277 . . . . 19.54 107.932 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.639 ' O ' ' N ' ' A' ' 56' ' ' THR 0.273 72.3 mmtt -138.28 162.9 33.16 Favored 'General case' 0 CA--C 1.551 0.989 0 O-C-N 126.252 2.22 . . . . 21.36 109.3 176.153 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 5.9 pt -120.51 139.53 47.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 N-CA-C 105.413 -2.069 . . . . 17.67 105.413 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.525 HG21 ' CD1' ' A' ' 32' ' ' ILE . 5.9 m -117.32 157.55 18.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 125.638 2.637 . . . . 14.57 108.199 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.77 157.15 20.92 Favored Glycine 0 CA--C 1.54 1.654 1 C-N-CA 131.695 4.474 . . . . 15.04 114.776 178.828 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -167.08 -164.87 23.51 Favored Glycine 0 C--O 1.254 1.378 1 CA-C-O 111.474 -5.07 . . . . 18.37 109.959 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.512 HD11 ' N ' ' B' ' 49' ' ' GLY 0.332 2.7 pp -58.19 -37.27 61.47 Favored 'Isoleucine or valine' 0 C--O 1.277 2.526 1 CA-C-N 124.704 4.252 . . . . 16.46 120.844 -179.381 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.506 ' HA3' ' N ' ' B' ' 52' ' ' GLY . . . -82.93 -18.24 65.74 Favored Glycine 0 N--CA 1.493 2.454 0 CA-C-O 126.243 3.135 . . . . 15.7 113.997 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' N ' ' HA3' ' B' ' 51' ' ' GLY . . . 154.31 -135.24 4.64 Favored Glycine 0 C--N 1.301 -1.409 0 O-C-N 117.088 -3.596 . . . . 14.67 112.162 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.446 ' HA ' ' O ' ' A' ' 47' ' ' VAL . 53.8 m-85 -123.62 135.67 54.07 Favored 'General case' 0 C--N 1.314 -0.948 1 C-N-CA 133.458 4.703 . . . . 17.87 115.907 -175.39 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.6 mt -115.88 158.58 16.22 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 O-C-N 127.883 3.24 . . . . 16.85 109.904 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -96.91 138.4 34.51 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 103.617 -2.734 . . . . 19.86 103.617 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . 0.639 ' N ' ' O ' ' A' ' 45' ' ' LYS . 78.7 p -134.52 170.9 15.07 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 125.876 1.985 . . . . 16.97 110.045 179.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . . . -120.78 104.25 9.74 Favored 'General case' 0 N--CA 1.44 -0.969 1 C-N-CA 132.738 4.415 . . . . 18.08 108.55 179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.531 ' OE1' HG23 ' A' ' 74' ' ' THR . 0.2 OUTLIER -89.48 122.08 32.32 Favored 'General case' 0 C--O 1.256 1.43 0 O-C-N 127.262 2.851 . . . . 20.71 113.329 -179.687 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -119.45 141.39 49.18 Favored 'General case' 0 C--O 1.251 1.152 0 N-CA-C 105.223 -2.14 . . . . 19.6 105.223 177.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -106.19 165.45 11.22 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 125.388 2.518 . . . . 21.07 112.492 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . . . 26.78 50.54 0.02 OUTLIER 'General case' 0 C--O 1.253 1.245 0 CA-C-N 111.121 -2.763 . . . . 23.68 113.113 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.595 ' O ' ' HA ' ' A' ' 72' ' ' ARG 0.306 0.9 OUTLIER -79.52 153.14 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 116.341 -2.143 . . . . 23.38 105.497 179.822 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.695 ' OE1' ' NZ ' ' A' ' 70' ' ' LYS 0.335 30.8 mt-10 -89.86 136.6 32.95 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 121.846 2.112 . . . . 26.9 110.263 179.34 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 10.8 mt -137.68 137.28 45.48 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 125.235 1.414 . . . . 21.86 114.219 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -125.56 124.86 42.2 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 106.096 -1.816 . . . . 25.84 106.096 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 12.0 p -151.12 142.94 16.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.372 0 N-CA-C 105.437 -2.06 . . . . 21.41 105.437 -178.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.906 HD13 HD23 ' B' ' 99' ' ' LEU . 62.9 mt 53.59 36.21 22.93 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 105.799 -1.926 . . . . 23.84 105.799 -179.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.275 51.7 t-20 57.15 30.25 17.99 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 112.0 -2.363 . . . . 27.21 113.161 176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -127.08 155.44 43.28 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 126.347 2.279 . . . . 28.63 107.401 -178.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.824 ' O ' HG23 ' A' ' 71' ' ' VAL . 10.4 mmmt -105.68 155.12 19.56 Favored 'General case' 0 CA--C 1.501 -0.909 0 N-CA-C 119.532 3.16 . . . . 28.4 119.532 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.824 HG23 ' O ' ' A' ' 70' ' ' LYS . 4.4 t -171.01 155.39 0.67 Allowed 'Isoleucine or valine' 0 C--O 1.213 -0.83 0 CA-C-O 123.452 1.596 . . . . 23.33 110.554 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HA ' ' O ' ' A' ' 62' ' ' VAL . 4.9 ttt180 -123.63 121.99 36.99 Favored 'General case' 0 C--O 1.27 2.17 1 N-CA-C 100.153 -4.017 . . . . 29.77 100.153 177.273 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -160.77 159.33 29.91 Favored 'General case' 0 N--CA 1.503 2.178 0 CA-C-O 113.865 -2.969 . . . . 19.97 111.44 -178.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . 0.531 HG23 ' OE1' ' A' ' 58' ' ' GLU . 1.9 m -55.37 132.41 48.06 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 124.031 3.105 . . . . 17.3 115.852 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.531 ' HB ' HG11 ' A' ' 62' ' ' VAL . 2.6 mm -123.19 123.9 68.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 O-C-N 117.714 -3.116 . . . . 15.93 111.697 176.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -107.08 121.57 44.75 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 127.006 2.692 . . . . 21.19 109.65 -178.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.7 m -95.44 149.08 21.78 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 125.591 3.814 . . . . 19.05 111.837 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.42 179.37 45.92 Favored Glycine 0 N--CA 1.476 1.304 0 CA-C-O 125.705 2.836 . . . . 20.7 119.343 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -87.34 69.14 9.93 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 128.308 2.643 . . . . 24.91 115.065 -176.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 8.8 t -106.54 132.29 21.02 Favored Pre-proline 0 C--N 1.318 -0.796 0 C-N-CA 131.307 3.843 . . . . 20.7 110.348 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.588 ' HG2' HE13 ' B' ' 100' ' ' 1ZK . 5.6 Cg_exo -59.11 -31.57 95.74 Favored 'Trans proline' 0 C--O 1.255 1.347 0 O-C-N 124.695 1.892 . . . . 19.78 109.949 177.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.701 HD11 ' H3 ' ' B' ' 100' ' ' 1ZK . 19.6 mt -139.95 152.76 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 117.417 -1.713 . . . . 17.96 109.196 -178.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.95 116.02 19.86 Favored 'General case' 0 CA--C 1.561 1.377 0 O-C-N 128.221 3.451 . . . . 14.21 104.114 178.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 10.2 pt -102.82 135.59 39.41 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 CA-C-O 115.026 -2.416 . . . . 12.08 109.817 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 1.1 m-30 -113.39 99.24 7.63 Favored 'General case' 0 CA--C 1.565 1.539 0 O-C-N 127.177 2.798 . . . . 10.97 105.372 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.68 -172.28 48.04 Favored Glycine 0 CA--C 1.49 -1.527 0 N-CA-C 119.169 2.427 . . . . 10.3 119.169 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.415 ' NH1' ' O ' ' B' ' 5' ' ' LEU . 41.3 mtm105 -55.57 -27.06 46.95 Favored 'General case' 0 C--O 1.28 2.669 0 N-CA-C 119.127 3.01 . . . . 11.11 119.127 -176.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' N ' ' OD1' ' A' ' 88' ' ' ASN . 21.6 p-10 -62.64 -35.36 79.35 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 124.955 1.409 . . . . 13.83 111.108 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 6.4 mt -90.74 -36.98 8.77 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.807 0 C-N-CA 126.239 1.816 . . . . 14.09 109.774 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.75 -32.83 67.85 Favored 'General case' 0 C--N 1.307 -1.254 0 C-N-CA 120.241 -0.584 . . . . 12.76 109.88 178.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 p -78.85 -31.92 45.84 Favored 'General case' 0 C--N 1.304 -1.409 0 O-C-N 118.328 -2.732 . . . . 12.86 112.886 -178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.72 -40.19 91.95 Favored 'General case' 0 C--O 1.254 1.336 0 C-N-CA 128.448 2.699 . . . . 14.01 107.989 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.6 mt -81.13 -16.34 53.3 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 113.636 -1.62 . . . . 15.24 114.113 177.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 81.7 26.92 48.76 Favored Glycine 0 CA--C 1.535 1.296 0 C-N-CA 127.768 2.604 . . . . 15.7 112.946 -178.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 4.3 mmm -73.63 156.9 37.53 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 126.764 2.025 . . . . 18.09 108.13 -177.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 83.0 p -148.92 171.68 15.93 Favored 'General case' 0 N--CA 1.487 1.392 1 O-C-N 129.476 4.235 . . . . 16.81 109.757 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.4 mt -119.01 129.08 54.95 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 102.924 -2.991 . . . . 18.09 102.924 177.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.531 ' O ' ' HA ' ' B' ' 95' ' ' MET . 3.0 m-80 -124.28 144.65 49.86 Favored 'General case' 0 C--O 1.251 1.175 0 O-C-N 127.406 2.941 . . . . 21.77 108.152 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 65.6 tp . . . . . 0 C--O 1.256 1.409 0 CA-C-O 126.336 2.969 . . . . 19.13 113.58 177.149 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PRO . . . . . 0.713 ' N ' ' O ' ' A' ' 408' ' ' HOH . 65.3 Cg_endo . . . . . 0 C--O 1.264 1.782 0 CA-C-O 115.183 -2.091 . . . . 25.6 113.762 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -178.66 152.83 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 120.786 1.63 . . . . 24.93 110.359 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -142.48 133.79 26.25 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 125.056 1.472 . . . . 25.4 113.895 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' SER . . . . . 0.798 ' O ' ' O ' ' B' ' 409' ' ' HOH . 13.2 m -90.15 160.05 16.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.334 1.854 . . . . 20.39 107.11 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.415 ' O ' ' NH1' ' A' ' 87' ' ' ARG 0.422 0.0 OUTLIER -101.77 13.24 35.43 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.006 1.113 . . . . 16.76 114.006 179.4 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 49.8 m95 -58.68 -46.43 87.26 Favored 'General case' 0 C--O 1.248 1.005 0 C-N-CA 129.574 3.15 . . . . 17.81 108.025 179.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -118.24 156.66 28.43 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 109.645 -3.434 . . . . 17.38 108.972 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -57.36 131.86 81.27 Favored Pre-proline 0 CA--C 1.512 -0.513 0 O-C-N 125.922 2.014 . . . . 12.37 106.615 178.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -76.4 74.66 4.61 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 O-C-N 126.537 2.862 . . . . 10.14 109.074 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 19.1 t -99.4 125.95 52.84 Favored 'Isoleucine or valine' 0 C--O 1.278 2.569 0 C-N-CA 126.53 1.932 . . . . 12.97 113.638 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . 0.509 HG21 HD21 ' B' ' 67' ' ' LEU 0.331 0.3 OUTLIER -125.76 160.66 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 128.03 3.331 . . . . 11.56 116.868 -178.452 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 33.4 m -94.63 112.65 24.4 Favored 'General case' 0 C--O 1.254 1.333 0 O-C-N 119.585 -1.947 . . . . 13.4 109.496 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . 0.448 ' HB2' ' CG1' ' B' ' 66' ' ' VAL . . . -111.2 170.1 8.34 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 126.812 2.045 . . . . 15.06 109.687 -179.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' TYR . . . . . 0.551 ' CD2' ' O ' ' B' ' 17' ' ' GLY . 3.7 m-85 -140.45 103.41 4.55 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 116.471 -1.728 . . . . 17.57 108.541 -178.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 58.5 mt -101.42 95.58 4.08 Favored 'Isoleucine or valine' 0 C--O 1.266 1.951 0 O-C-N 125.463 1.727 . . . . 17.84 109.979 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . 0.412 1.9 mp0 56.19 59.06 3.89 Favored 'General case' 0 C--O 1.271 2.206 0 O-C-N 128.204 3.44 . . . . 17.44 107.25 -177.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' B' ' 14' ' ' TYR . . . 98.33 -52.59 1.2 Allowed Glycine 0 C--O 1.248 1.029 1 O-C-N 129.298 4.124 . . . . 15.35 115.786 179.994 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -71.25 111.22 9.31 Favored Pre-proline 0 C--O 1.25 1.127 0 N-CA-C 117.61 2.448 . . . . 17.38 117.61 -176.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' B' ' 13' ' ' ALA . 90.2 Cg_endo -73.64 144.13 35.08 Favored 'Trans proline' 0 C--N 1.316 -1.179 0 C-N-CA 123.775 2.984 . . . . 12.92 112.116 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 12.5 m -157.18 148.81 10.49 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 127.535 3.022 . . . . 11.73 113.625 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' B' ' 440' ' ' HOH . 43.6 mt-10 -83.84 112.49 20.17 Favored 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 128.088 2.555 . . . . 15.2 108.819 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.419 ' O ' ' N ' ' B' ' 11' ' ' VAL . 21.3 m -116.2 143.8 25.4 Favored 'Isoleucine or valine' 0 C--O 1.256 1.427 0 O-C-N 126.523 2.389 . . . . 7.08 113.856 -178.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 46.2 tp -93.41 125.19 37.89 Favored 'General case' 0 C--O 1.264 1.84 0 CA-C-O 116.024 -1.941 . . . . 4.92 108.845 178.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 29.3 mt -78.01 109.18 11.85 Favored 'General case' 0 C--N 1.285 -2.205 0 N-CA-C 104.957 -2.238 . . . . 6.52 104.957 176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.465 ' OD2' ' OB1' ' B' ' 100' ' ' 1ZK . 58.4 t0 -125.87 107.68 10.72 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 118.365 2.728 . . . . 9.57 118.365 -174.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . 0.717 HG21 HD22 ' B' ' 97' ' ' LEU . 76.3 p -72.2 -1.85 16.61 Favored 'General case' 0 C--O 1.247 0.96 0 O-C-N 125.116 1.51 . . . . 11.79 111.24 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -99.27 2.38 57.75 Favored Glycine 0 C--N 1.3 -1.444 0 C-N-CA 126.338 1.923 . . . . 7.74 116.565 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.426 ' HA ' ' HA ' ' B' ' 100' ' ' 1ZK . . . -114.55 133.14 56.02 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 128.732 2.813 . . . . 7.89 110.454 -179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.72 -33.74 60.32 Favored 'General case' 0 C--N 1.286 -2.192 0 O-C-N 126.193 2.183 . . . . 11.14 110.386 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . 0.799 ' HB2' ' HE2' ' B' ' 100' ' ' 1ZK . 37.3 m-20 -121.82 167.44 13.0 Favored 'General case' 0 C--N 1.294 -1.842 1 C-N-CA 137.328 6.251 . . . . 12.75 115.737 -177.291 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 15.5 m -111.18 133.19 53.72 Favored 'General case' 0 C--O 1.253 1.274 1 O-C-N 130.268 4.73 . . . . 10.84 110.759 178.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . 0.406 HD11 HG21 ' B' ' 47' ' ' VAL . 1.8 mt -131.75 134.63 60.04 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 O-C-N 126.38 2.3 . . . . 10.52 114.938 179.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -137.2 163.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-O 121.584 0.707 . . . . 13.33 112.409 -178.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.78 161.85 34.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 105.828 -1.915 . . . . 15.1 105.828 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.557 ' O ' HD13 ' B' ' 36' ' ' ILE . . . 61.27 58.93 11.03 Favored Glycine 0 C--N 1.302 -1.33 0 O-C-N 127.715 3.134 . . . . 19.81 109.651 179.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.557 HD13 ' O ' ' B' ' 35' ' ' GLY . 5.4 mm -155.45 123.27 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 N-CA-C 103.323 -2.843 . . . . 21.68 103.323 -178.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . -96.91 85.93 3.89 Favored 'General case' 0 C--O 1.259 1.572 0 CA-C-O 113.137 -3.316 . . . . 23.05 113.156 -178.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.434 HD12 ' CD2' ' B' ' 59' ' ' TYR . 75.7 mt -70.39 -33.54 71.5 Favored 'General case' 0 C--O 1.282 2.775 0 N-CA-C 120.479 3.511 . . . . 21.83 120.479 -178.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 133.66 179.86 16.78 Favored Glycine 0 N--CA 1.474 1.209 0 CA-C-N 124.182 3.173 . . . . 20.25 110.668 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -100.06 37.34 1.66 Allowed 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 118.016 0.908 . . . . 23.1 110.421 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . 0.319 . . -111.6 57.98 0.63 Allowed 'General case' 0 C--O 1.263 1.79 0 C-N-CA 130.076 3.35 . . . . 20.9 112.409 -178.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' TYR . . . . . . . . . . . . . 27.2 p90 -137.19 173.47 11.66 Favored 'General case' 0 C--O 1.247 0.96 0 N-CA-C 120.044 3.349 . . . . 18.79 120.044 -176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' SER . . . . . 0.428 ' O ' ' N ' ' B' ' 58' ' ' GLU . 5.7 m -129.24 133.17 24.86 Favored Pre-proline 0 CA--C 1.548 0.884 0 N-CA-C 102.782 -3.044 . . . . 18.43 102.782 177.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -85.37 152.24 10.57 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 127.069 3.141 . . . . 17.45 112.676 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.688 ' HD2' ' HB2' ' B' ' 58' ' ' GLU . 0.0 OUTLIER -167.77 157.53 10.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 116.267 1.951 . . . . 17.9 116.267 178.761 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ILE . . . . . 0.524 ' O ' HG13 ' B' ' 46' ' ' ILE . 6.6 pt -99.0 97.05 5.51 Favored 'Isoleucine or valine' 0 C--O 1.249 1.039 0 O-C-N 128.656 3.723 . . . . 20.39 116.297 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' VAL . . . . . 0.486 HG23 ' ND1' ' B' ' 100' ' ' 1ZK . 0.2 OUTLIER -100.97 147.21 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 N-CA-C 105.755 -1.942 . . . . 20.59 105.755 177.284 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.617 ' HA3' ' CE1' ' B' ' 53' ' ' PHE . . . -123.84 164.56 17.0 Favored Glycine 0 C--N 1.312 -0.788 0 CA-C-O 117.532 -1.704 . . . . 18.8 116.004 -178.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 50' ' ' ILE . . . -172.63 -153.62 9.55 Favored Glycine 0 N--CA 1.479 1.539 0 O-C-N 126.46 1.918 . . . . 19.27 111.583 179.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -67.87 128.77 31.76 Favored 'Isoleucine or valine' 0 C--O 1.262 1.759 0 CA-C-N 118.833 1.317 . . . . 19.86 109.242 178.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . 0.491 ' C ' ' HA3' ' A' ' 51' ' ' GLY . . . 96.47 -9.4 66.88 Favored Glycine 0 N--CA 1.468 0.824 0 CA-C-O 123.037 1.354 . . . . 18.05 116.197 -179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLY . . . . . 0.506 ' N ' ' HA3' ' A' ' 51' ' ' GLY . . . 116.85 -150.03 18.63 Favored Glycine 0 C--N 1.295 -1.713 0 C-N-CA 130.365 3.841 . . . . 18.82 115.225 178.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' PHE . . . . . 0.617 ' CE1' ' HA3' ' B' ' 48' ' ' GLY . 76.4 m-85 -99.29 159.56 14.91 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 110.927 -2.637 . . . . 20.04 117.52 -178.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 32.3 pt -148.32 159.31 7.22 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 N-CA-C 102.309 -3.219 . . . . 16.06 102.309 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASN . . . . . . . . . . . . 0.286 11.6 m-80 -101.51 146.19 27.99 Favored 'General case' 0 C--N 1.291 -1.959 2 O-C-N 130.483 4.864 . . . . 15.81 107.356 179.81 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . 0.401 ' N ' ' O ' ' B' ' 45' ' ' LYS . 0.9 OUTLIER -145.46 162.93 36.19 Favored 'General case' 0 C--O 1.257 1.458 1 O-C-N 129.202 4.064 . . . . 13.25 113.424 -179.879 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 44.4 mt -103.04 124.68 48.98 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 102.517 -3.142 . . . . 14.19 102.517 175.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.688 ' HB2' ' HD2' ' B' ' 45' ' ' LYS . 19.1 tt0 -96.12 130.57 43.12 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 127.464 2.977 . . . . 17.21 109.698 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.434 ' CD2' HD12 ' B' ' 38' ' ' LEU . 85.0 m-85 -127.19 104.4 7.94 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 126.561 1.944 . . . . 18.2 115.356 -178.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -78.31 150.33 33.33 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 126.839 2.056 . . . . 23.21 114.415 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.92 ' ND2' ' HD2' ' B' ' 72' ' ' ARG . 1.4 t-20 63.97 20.96 12.44 Favored 'General case' 0 C--N 1.302 -1.494 1 C-N-CA 132.67 4.388 . . . . 21.79 119.438 176.717 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 94.1 t -61.58 151.85 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-O 114.402 -2.713 . . . . 19.72 107.931 -179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . 0.522 ' C ' HG13 ' B' ' 64' ' ' ILE . 0.3 OUTLIER -104.96 139.54 39.52 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-O 124.358 2.028 . . . . 23.71 109.276 179.494 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.522 HG13 ' C ' ' B' ' 63' ' ' GLU 0.273 7.1 mt -133.17 155.15 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 113.675 -1.602 . . . . 18.02 110.521 -179.077 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . . . -142.99 119.86 11.26 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 103.773 -2.677 . . . . 18.24 103.773 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.649 HG23 HD21 ' B' ' 93' ' ' LEU . 0.0 OUTLIER -147.42 129.27 6.62 Favored 'Isoleucine or valine' 0 C--O 1.256 1.408 0 C-N-CA 130.385 3.474 . . . . 19.84 112.462 -177.867 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' B' ' 66' ' ' VAL . 69.6 mt 56.94 38.05 29.16 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 125.939 2.024 . . . . 20.38 113.187 175.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.505 ' C ' ' HD2' ' B' ' 69' ' ' LYS . 26.2 m120 62.19 37.03 14.6 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 112.948 -3.406 . . . . 20.53 113.698 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.528 ' HB2' HD23 ' B' ' 93' ' ' LEU 0.261 13.8 mptt -137.27 147.3 45.62 Favored 'General case' 0 C--N 1.298 -1.663 1 CA-C-O 111.162 -4.256 . . . . 23.15 100.832 178.255 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.473 ' HE2' ' H ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -114.98 136.98 52.53 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 128.126 3.391 . . . . 19.07 103.026 -179.716 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . . . -145.72 169.88 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-O 112.672 -3.537 . . . . 16.67 107.963 -179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.92 ' HD2' ' ND2' ' B' ' 61' ' ' ASN . 6.0 mmt180 -127.61 126.68 42.49 Favored 'General case' 0 C--N 1.294 -1.82 0 CA-C-O 113.851 -2.976 . . . . 15.48 105.727 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -162.07 166.1 26.3 Favored 'General case' 0 CA--C 1.5 -0.951 0 O-C-N 127.445 2.966 . . . . 13.57 116.44 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 2.3 m -65.83 144.59 56.74 Favored 'General case' 0 N--CA 1.482 1.154 0 CA-C-O 126.954 3.264 . . . . 12.35 109.457 177.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 1.2 mt -145.78 129.77 11.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.065 0 CA-C-O 113.566 -3.112 . . . . 15.49 105.534 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' MET . . . . . . . . . . . . . 53.7 mtt -101.58 147.01 26.91 Favored 'General case' 0 C--N 1.31 -1.149 1 O-C-N 131.9 5.75 . . . . 20.48 108.662 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' THR . . . . . . . . . . . . . 15.1 m -116.87 138.27 51.63 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 115.394 -2.241 . . . . 15.25 105.904 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.58 178.86 41.03 Favored Glycine 0 C--O 1.244 0.752 0 CA-C-O 124.812 2.34 . . . . 17.16 113.758 179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASP . . . . . . . . . . . . . 18.2 t0 -69.26 66.95 0.18 Allowed 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.649 2.092 . . . . 18.06 116.649 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' THR . . . . . . . . . . . . . 7.3 t -102.83 134.06 20.06 Favored Pre-proline 0 C--O 1.259 1.572 0 N-CA-C 101.073 -3.677 . . . . 17.18 101.073 178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.458 ' HG2' HG22 ' B' ' 82' ' ' ILE . 87.9 Cg_endo -72.53 -13.6 27.54 Favored 'Trans proline' 0 C--O 1.268 1.991 0 C-N-CA 123.906 3.071 . . . . 15.78 116.327 -178.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . 0.458 HG22 ' HG2' ' B' ' 81' ' ' PRO 0.371 3.9 tp -147.17 134.94 14.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 CA-C-N 110.661 -2.972 . . . . 14.13 104.218 -178.537 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASN . . . . . . . . . . . . . 85.9 m-20 -68.11 138.14 55.5 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 114.937 -2.459 . . . . 12.08 105.347 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 77.9 mt -123.18 133.41 69.19 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 O-C-N 127.68 3.113 . . . . 11.0 117.044 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' PHE . . . . . . . . . . . . . 2.2 m-30 -114.87 102.67 10.2 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 103.871 -2.64 . . . . 12.58 103.871 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLY . . . . . . . . . . . . . . . -89.02 -173.57 46.52 Favored Glycine 0 C--N 1.289 -2.031 0 O-C-N 128.019 3.324 . . . . 7.72 111.957 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ARG . . . . . . . . . . . . . 24.6 mtm105 -59.18 -21.32 59.25 Favored 'General case' 0 C--O 1.245 0.84 0 CA-C-O 113.383 -3.198 . . . . 10.6 115.46 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -68.79 -40.65 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 O-C-N 127.302 2.876 . . . . 12.15 107.251 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ILE . . . . . . . . . . . . . 62.0 mt -81.31 -28.45 10.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.264 0 O-C-N 125.603 1.815 . . . . 9.96 113.741 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 54.0 mt -65.43 -47.07 77.46 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 120.576 1.534 . . . . 11.2 112.004 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 31.4 p -68.5 -19.8 64.55 Favored 'General case' 0 C--O 1.242 0.695 0 O-C-N 127.041 2.713 . . . . 10.96 110.969 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.33 -20.39 57.31 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 116.775 -3.703 . . . . 11.98 110.148 -179.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.649 HD21 HG23 ' B' ' 66' ' ' VAL . 9.2 mt -107.17 -6.54 17.27 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.584 1.154 . . . . 10.9 113.083 -179.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 44.02 27.66 Favored Glycine 0 C--N 1.292 -1.877 0 C-N-CA 129.766 3.555 . . . . 11.84 114.504 -179.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 98' ' ' ASN . 2.4 ttt -93.76 152.93 18.59 Favored 'General case' 0 C--O 1.267 2.024 0 N-CA-C 108.017 -1.105 . . . . 15.0 108.017 -178.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 84.1 p -147.44 165.1 31.26 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-O 112.826 -3.464 . . . . 14.5 103.501 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.717 HD22 HG21 ' B' ' 26' ' ' THR 0.32 0.0 OUTLIER -101.61 132.8 47.09 Favored 'General case' 0 C--N 1.286 -2.185 2 O-C-N 130.353 4.783 . . . . 16.42 100.507 175.741 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -128.26 171.85 11.59 Favored 'General case' 0 C--N 1.289 -2.064 0 CA-C-N 125.583 3.811 . . . . 21.25 108.468 179.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . 0.906 HD23 HD13 ' A' ' 67' ' ' LEU 0.279 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.501 1 CA-C-O 111.208 -4.234 . . . . 19.4 108.896 178.953 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' 1ZK . . . . . 1.136 CD11 HD15 ' B' ' 100' ' ' 1ZK . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . 0.713 ' O ' ' N ' ' B' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 409' ' ' HOH . . . . . 0.798 ' O ' ' O ' ' B' ' 4' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 440' ' ' HOH . . . . . 0.451 ' O ' ' HG2' ' B' ' 21' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_