data_2otx_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 2otx _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 ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 2 CA--C 1.593 4.942 0 CA-C-O 114.688 -3.284 . . . . 100.84 116.473 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . 0.449 0.4 OUTLIER -110.41 89.51 8.83 Favored Pre-proline 2 N--CA 1.603 7.222 0 C-N-CA 130.4 3.48 . . . . 98.3 120.042 146.979 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_exo -53.75 -54.81 4.23 Favored 'Trans proline' 0 N--CA 1.43 -2.224 1 N-CA-C 124.973 4.951 . . . . 85.15 124.973 -133.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -50.75 -44.32 58.42 Favored 'General case' 1 CA--C 1.415 -4.213 0 CA-C-N 122.511 2.414 . . . . 80.09 114.969 -172.209 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.303 2.7 pt-20 -73.07 -21.62 60.74 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 119.69 3.218 . . . . 74.61 119.69 -174.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . 1.624 ' CG1' ' CD1' ' A' ' 17' ' ' ILE . 29.2 mm -79.01 -47.49 22.7 Favored 'Isoleucine or valine' 1 N--CA 1.35 -5.457 0 O-C-N 126.124 2.14 . . . . 51.3 107.596 177.139 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.25 85.3 mtm-85 -60.24 -29.23 68.62 Favored 'General case' 0 C--O 1.278 2.563 0 C-N-CA 115.75 -2.38 . . . . 52.36 115.876 172.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 194' ' ' LYS . 98.0 m-20 -60.1 -42.51 94.84 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 115.863 -0.608 . . . . 54.47 111.776 171.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.52 -45.62 78.91 Favored 'General case' 0 C--O 1.17 -3.079 0 N-CA-C 115.86 1.8 . . . . 47.82 115.86 175.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.74 -34.63 77.22 Favored 'General case' 0 N--CA 1.395 -3.19 0 C-N-CA 118.713 -1.195 . . . . 50.08 110.417 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.53 74.31 Favored 'General case' 0 CA--C 1.586 2.343 0 N-CA-C 114.937 1.458 . . . . 48.8 114.937 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.78 -39.97 95.54 Favored 'General case' 0 C--O 1.287 3.07 0 C-N-CA 123.925 0.89 . . . . 63.26 112.986 172.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.4 t -58.52 -54.63 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 115.868 -0.605 . . . . 47.28 112.003 172.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.94 -41.17 70.71 Favored 'General case' 0 C--O 1.168 -3.236 0 N-CA-C 118.096 2.628 . . . . 58.53 118.096 173.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.2 m -58.72 -53.25 60.52 Favored 'General case' 0 C--O 1.167 -3.276 0 C-N-CA 125.688 1.595 . . . . 54.5 108.457 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -51.48 -65.51 0.54 Allowed 'General case' 0 N--CA 1.395 -3.224 0 N-CA-C 120.269 3.433 . . . . 54.04 120.269 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.4 t -62.1 -46.36 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.427 -3.786 0 O-C-N 119.88 -1.762 . . . . 51.04 112.87 178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.21 -43.73 50.26 Favored 'General case' 0 CA--C 1.619 3.633 0 C-N-CA 116.489 -2.084 . . . . 55.96 114.856 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -103.74 -54.64 2.53 Favored 'General case' 0 C--O 1.289 3.145 0 C-N-CA 117.104 -1.838 . . . . 70.56 115.184 -172.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 57.1 m -48.88 -43.1 38.73 Favored 'General case' 0 N--CA 1.394 -3.263 0 C-N-CA 118.631 -1.228 . . . . 55.77 113.021 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 48.1 mt -82.75 -8.76 59.57 Favored 'General case' 0 C--O 1.179 -2.65 0 CA-C-O 117.646 -1.169 . . . . 52.26 111.008 -174.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 tttm -69.62 135.83 50.44 Favored 'General case' 0 C--O 1.303 3.906 0 O-C-N 125.467 1.729 . . . . 78.84 108.299 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.88 -17.29 16.93 Favored Glycine 0 N--CA 1.478 1.451 0 CA-C-N 115.259 -0.882 . . . . 62.55 113.888 -171.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' OE2' ' OG ' ' B' ' 38' ' ' SER . 49.6 mm-40 -70.44 161.27 30.84 Favored 'General case' 0 C--O 1.164 -3.433 0 O-C-N 119.235 -2.332 . . . . 67.48 113.157 -174.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -96.52 92.82 6.45 Favored 'General case' 0 C--N 1.282 -2.341 0 O-C-N 118.224 -2.798 . . . . 71.13 108.056 -169.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.8 mt -111.04 154.51 24.1 Favored 'General case' 0 C--O 1.264 1.856 0 C-N-CA 118.736 -1.185 . . . . 68.39 110.563 -166.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -55.99 170.07 0.33 Allowed 'General case' 0 CA--C 1.485 -1.525 0 N-CA-C 107.316 -1.364 . . . . 71.56 107.316 171.964 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.4 tttp -75.22 -29.92 60.42 Favored 'General case' 0 CA--C 1.593 2.629 0 N-CA-C 109.07 -0.715 . . . . 90.41 109.07 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . 0.451 ' CD ' ' O ' ' A' ' 232' ' ' HOH . 14.5 tttm -73.46 -57.55 3.93 Favored 'General case' 1 N--CA 1.377 -4.087 0 N-CA-C 102.226 -3.25 . . . . 88.15 102.226 -173.761 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.55 -31.81 25.74 Favored 'General case' 0 CA--C 1.582 2.211 0 CA-C-O 117.935 -1.031 . . . . 67.46 113.685 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.0 mttt -70.75 -37.05 73.4 Favored 'General case' 0 C--O 1.156 -3.855 0 CA-C-N 120.071 1.305 . . . . 82.16 108.942 -178.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -78.29 -37.78 44.07 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 105.097 -2.186 . . . . 86.78 105.097 -167.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -69.73 -33.51 72.57 Favored 'General case' 0 C--O 1.182 -2.473 0 N-CA-C 117.769 2.507 . . . . 73.22 117.769 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.7 ttt-85 -63.72 -30.33 71.44 Favored 'General case' 1 N--CA 1.366 -4.634 0 CA-C-N 115.425 -0.807 . . . . 59.38 110.972 173.046 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -81.77 -43.91 17.72 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 102.835 -3.024 . . . . 92.91 102.835 -168.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -46.5 -55.35 7.65 Favored 'General case' 0 N--CA 1.396 -3.174 0 N-CA-C 118.356 2.725 . . . . 58.91 118.356 166.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.34 -37.15 84.53 Favored 'General case' 1 N--CA 1.365 -4.681 0 CA-C-O 116.272 -1.823 . . . . 61.13 108.208 -174.657 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.6 -42.87 89.66 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.713 0 O-C-N 124.713 1.258 . . . . 48.72 111.344 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -63.56 -47.33 81.97 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.875 1.359 . . . . 77.51 108.66 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . 0.506 ' NZ ' ' OD2' ' B' ' 23' ' ' ASP . 85.2 mttt -59.81 -38.19 81.27 Favored 'General case' 0 C--O 1.17 -3.124 0 N-CA-C 115.228 1.566 . . . . 53.89 115.228 177.191 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -59.6 -43.2 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.414 0 CA-C-O 122.678 1.228 . . . . 50.59 113.276 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . 0.318 69.2 mttt -57.78 -44.1 85.98 Favored 'General case' 0 C--O 1.259 1.586 0 CA-C-N 111.674 -2.512 . . . . 73.69 115.974 175.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -78.71 -25.61 44.69 Favored 'General case' 1 C--O 1.139 -4.719 0 N-CA-C 106.641 -1.614 . . . . 77.69 106.641 -170.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -73.81 -14.55 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.453 0 CA-C-N 122.493 2.406 . . . . 50.4 110.554 -171.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 mttt -64.2 -26.2 68.41 Favored 'General case' 0 C--O 1.192 -1.937 0 C-N-CA 126.139 1.775 . . . . 51.51 112.312 -172.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 p -72.95 -8.64 56.57 Favored 'General case' 0 CA--C 1.427 -3.773 0 CA-C-O 124.41 2.052 . . . . 53.98 114.099 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -24.84 14.68 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.698 0 CA-C-N 113.205 -1.816 . . . . 55.87 110.336 -174.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -94.14 8.03 43.1 Favored 'General case' 1 N--CA 1.365 -4.677 0 O-C-N 120.156 -1.59 . . . . 51.55 108.018 -173.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.61 -55.14 17.7 Favored 'General case' 0 CA--C 1.472 -2.055 0 N-CA-C 119.053 2.983 . . . . 60.69 119.053 171.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -52.13 -26.85 12.25 Favored 'General case' 0 C--O 1.191 -1.988 0 C-N-CA 126.096 1.758 . . . . 96.23 111.747 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -66.1 -30.94 71.53 Favored 'General case' 0 CA--C 1.448 -2.97 0 O-C-N 121.484 -0.76 . . . . 72.95 112.134 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -99.14 0.42 43.42 Favored 'General case' 1 C--O 1.132 -5.121 0 CA-C-O 115.344 -2.265 . . . . 57.86 112.393 -174.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . 0.656 ' C ' ' O ' ' A' ' 231' ' ' HOH . 91.4 mt-30 . . . . . 0 N--CA 1.501 2.112 0 C-N-CA 130.453 3.501 . . . . 60.71 116.753 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 CA--C 1.477 -1.842 0 N-CA-C 114.157 1.169 . . . . 76.98 114.157 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -71.62 150.89 57.69 Favored 'Trans proline' 0 C--O 1.166 -3.098 0 N-CA-C 118.873 2.605 . . . . 74.95 118.873 -178.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.23 149.53 84.85 Favored 'Trans proline' 0 C--O 1.197 -1.542 0 CA-C-N 121.715 1.648 . . . . 70.63 112.679 175.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.1 tt -159.64 138.55 3.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 C-N-CA 125.58 1.552 . . . . 63.59 109.815 -175.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.88 153.58 39.79 Favored 'General case' 0 C--O 1.17 -3.124 0 O-C-N 120.553 -1.342 . . . . 64.22 111.685 -175.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -48.1 -49.03 33.27 Favored 'General case' 0 C--O 1.178 -2.7 0 O-C-N 119.995 -1.691 . . . . 60.54 114.421 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -80.48 -3.39 49.8 Favored 'General case' 0 C--O 1.17 -3.126 0 C-N-CA 125.883 1.673 . . . . 85.08 113.241 -171.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -106.48 1.89 25.87 Favored 'General case' 0 N--CA 1.407 -2.599 0 CA-C-N 119.928 1.24 . . . . 72.08 113.835 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 14.1 mt -60.48 124.42 78.37 Favored Pre-proline 0 CA--C 1.485 -1.543 0 CA-C-N 120.167 1.348 . . . . 63.97 109.392 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.4 160.85 35.25 Favored 'Trans proline' 1 CA--C 1.63 5.29 0 O-C-N 123.06 1.032 . . . . 50.67 114.021 174.258 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 5.5 t80 39.05 58.83 1.76 Allowed 'General case' 0 C--O 1.283 2.827 0 C-N-CA 126.079 1.752 . . . . 49.71 110.33 170.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 84.2 t -79.07 98.45 2.83 Favored 'Isoleucine or valine' 1 C--O 1.143 -4.52 0 CA-C-N 114.687 -1.142 . . . . 47.35 109.116 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 94.0 mt -69.51 -32.97 54.93 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.717 0 CA-C-O 116.605 -1.664 . . . . 50.13 115.152 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.9 tttp -159.33 142.76 14.61 Favored 'General case' 1 N--CA 1.358 -5.075 0 CA-C-O 123.937 1.827 . . . . 49.03 111.212 173.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -145.1 161.21 40.02 Favored 'General case' 1 C--O 1.124 -5.514 0 C-N-CA 116.798 -1.961 . . . . 51.38 105.847 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.96 165.89 25.13 Favored Glycine 0 N--CA 1.405 -3.367 0 CA-C-O 118.169 -1.351 . . . . 50.64 111.59 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -79.08 131.2 36.18 Favored 'General case' 0 C--O 1.186 -2.268 0 CA-C-O 122.105 0.955 . . . . 53.93 112.57 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 33.7 mt -135.52 158.3 44.72 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.785 -0.821 . . . . 50.19 108.785 175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -89.14 147.44 24.2 Favored 'General case' 0 N--CA 1.534 3.747 0 C-N-CA 114.61 -2.836 . . . . 78.23 110.379 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -137.48 151.38 48.41 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 103.659 -2.719 . . . . 75.34 103.659 -166.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . 0.42 ' CZ ' ' OG ' ' A' ' 131' ' ' SER . 46.4 ttp180 -169.13 130.16 1.14 Allowed 'General case' 0 N--CA 1.424 -1.756 0 N-CA-C 105.821 -1.918 . . . . 68.7 105.821 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -73.5 142.02 46.78 Favored 'General case' 0 CA--C 1.615 3.474 0 CA-C-O 122.048 0.928 . . . . 64.35 112.226 168.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -58.16 -37.83 75.44 Favored 'General case' 1 CA--C 1.419 -4.082 0 CA-C-N 114.17 -1.377 . . . . 60.49 112.828 -179.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.83 -11.51 59.58 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.076 -1.049 . . . . 56.28 110.57 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -85.38 -33.94 21.88 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 124.066 1.889 . . . . 50.77 114.646 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' SER . . . . . 0.42 ' OG ' ' CZ ' ' A' ' 126' ' ' ARG . 0.6 OUTLIER -57.05 -47.64 80.46 Favored 'General case' 0 C--N 1.27 -2.875 0 C-N-CA 126.417 1.887 . . . . 56.27 115.109 174.811 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -49.39 -34.28 15.86 Favored 'General case' 0 N--CA 1.384 -3.747 0 N-CA-C 114.596 1.332 . . . . 46.09 114.596 169.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 94.1 mt -89.58 0.13 57.13 Favored 'General case' 0 N--CA 1.51 2.556 0 CA-C-N 115.789 -0.642 . . . . 48.64 111.401 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.2 14.33 64.42 Favored Glycine 0 N--CA 1.417 -2.627 0 N-CA-C 120.118 2.807 . . . . 50.97 120.118 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -69.47 140.29 54.0 Favored 'General case' 0 C--O 1.165 -3.343 0 CA-C-N 118.205 1.003 . . . . 63.6 111.252 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . 1.524 ' CG ' ' CD ' ' A' ' 136' ' ' GLU 0.255 1.1 tt0 -68.44 146.28 53.33 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-O 123.681 1.705 . . . . 96.46 112.346 -179.436 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -52.24 146.14 9.69 Favored 'General case' 0 N--CA 1.401 -2.92 0 O-C-N 119.413 -2.054 . . . . 68.33 111.343 162.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.8 130.13 55.62 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 129.524 3.13 . . . . 81.32 107.544 178.042 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LYS . . . . . 1.603 ' CD ' ' CE ' ' A' ' 139' ' ' LYS . 0.4 OUTLIER -67.52 128.01 34.85 Favored 'General case' 0 CA--C 1.59 2.5 0 N-CA-C 104.36 -2.459 . . . . 82.17 104.36 174.164 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ARG . . . . . 0.47 ' NH1' ' O ' ' A' ' 139' ' ' LYS . 70.8 mmt-85 -139.06 148.59 43.55 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 117.72 -1.592 . . . . 51.87 107.952 176.114 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 34.0 t90 -90.58 118.67 30.21 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 102.824 -3.028 . . . . 63.24 102.824 168.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 72.6 m -108.2 140.58 41.22 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.145 -0.934 . . . . 49.66 110.103 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -139.41 133.77 31.48 Favored 'General case' 0 CA--C 1.425 -3.838 0 CA-C-N 114.066 -1.425 . . . . 46.02 113.585 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 50.9 tp -101.99 100.32 10.59 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 125.026 1.454 . . . . 46.57 110.737 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . 0.25 23.2 t -107.44 109.92 21.75 Favored 'General case' 0 C--O 1.268 2.029 0 N-CA-C 106.111 -1.811 . . . . 53.16 106.111 -170.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 27.3 mttt 53.96 -124.52 2.23 Favored 'General case' 1 C--O 1.148 -4.278 0 C-N-CA 116.057 -2.257 . . . . 75.22 112.178 -165.149 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' THR . . . . . 0.692 ' CG2' ' O ' ' A' ' 226' ' ' HOH . 1.9 m -97.24 18.37 15.2 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 127.646 2.378 . . . . 61.45 108.659 -178.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 76.4 t -130.72 132.83 64.01 Favored 'Isoleucine or valine' 0 C--O 1.288 3.13 1 O-C-N 116.281 -4.012 . . . . 52.05 108.366 -174.213 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -95.39 122.12 37.78 Favored 'General case' 1 N--CA 1.376 -4.157 0 O-C-N 127.787 3.179 . . . . 47.23 110.63 -174.13 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -116.6 150.5 37.95 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 118.94 -2.35 . . . . 51.68 112.973 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -135.48 136.81 41.57 Favored 'General case' 0 C--O 1.179 -2.644 0 C-N-CA 117.664 -1.614 . . . . 50.66 111.093 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -130.28 159.51 36.7 Favored 'General case' 0 C--O 1.287 3.043 0 O-C-N 126.295 2.247 . . . . 59.08 112.235 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.46 -49.14 40.09 Favored Glycine 0 C--O 1.195 -2.334 0 N-CA-C 115.939 1.135 . . . . 55.85 115.939 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 60.7 p -152.37 177.48 10.54 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 103.918 -2.623 . . . . 62.24 103.918 172.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -69.84 0.48 5.69 Favored 'General case' 1 C--O 1.312 4.356 0 N-CA-C 117.51 2.411 . . . . 70.02 117.51 177.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -113.3 4.27 16.34 Favored 'General case' 0 C--O 1.18 -2.603 0 CA-C-O 115.248 -2.311 . . . . 89.01 110.685 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.22 161.0 31.06 Favored 'General case' 0 CA--C 1.463 -2.377 0 N-CA-C 106.08 -1.822 . . . . 70.99 106.08 -171.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -4.62 26.2 Favored 'General case' 1 C--O 1.137 -4.839 0 CA-C-O 125.696 2.665 . . . . 94.76 106.663 -173.537 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -158.09 148.04 20.07 Favored 'General case' 0 C--N 1.26 -3.316 1 O-C-N 116.027 -4.171 . . . . 90.03 105.895 -174.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -81.72 152.64 26.95 Favored 'General case' 0 C--O 1.265 1.893 0 C-N-CA 124.101 0.961 . . . . 64.89 112.773 -175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 15.5 mmtm -78.81 -17.33 55.88 Favored 'General case' 0 C--O 1.177 -2.737 0 N-CA-C 108.65 -0.87 . . . . 78.27 108.65 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 166.19 160.68 13.79 Favored Glycine 0 C--O 1.29 3.602 1 N-CA-C 101.042 -4.823 . . . . 57.41 101.042 -165.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.81 169.37 24.51 Favored 'General case' 1 C--O 1.092 -7.187 0 CA-C-O 123.638 1.685 . . . . 62.77 112.126 169.338 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -157.68 142.58 16.67 Favored 'General case' 0 C--N 1.267 -2.998 0 O-C-N 117.44 -3.287 . . . . 53.39 109.679 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.43 129.7 37.74 Favored 'General case' 0 C--O 1.18 -2.559 0 C-N-CA 126.108 1.763 . . . . 51.45 108.629 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ILE . . . . . 0.402 ' O ' ' C ' ' A' ' 167' ' ' ASP . 28.1 pt -84.72 -10.06 11.49 Favored 'Isoleucine or valine' 1 C--O 1.125 -5.459 0 N-CA-C 116.105 1.891 . . . . 54.31 116.105 -173.692 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASP . . . . . 0.402 ' C ' ' O ' ' A' ' 166' ' ' ILE . 15.3 t70 -42.12 122.71 2.21 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 120.018 1.281 . . . . 61.92 112.714 172.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.68 -3.95 78.75 Favored Glycine 0 C--O 1.252 1.255 0 C-N-CA 117.602 -2.237 . . . . 59.25 115.879 173.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -87.35 161.14 18.08 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 105.518 -2.031 . . . . 79.1 105.518 -176.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -114.36 157.84 22.28 Favored 'General case' 0 N--CA 1.393 -3.294 0 O-C-N 120.06 -1.65 . . . . 81.84 110.717 164.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.9 p -135.41 145.8 31.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 121.527 0.679 . . . . 55.06 111.267 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -158.07 156.36 30.89 Favored 'General case' 0 C--O 1.165 -3.383 0 N-CA-C 118.801 2.889 . . . . 73.93 118.801 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 78.5 mmm -65.34 145.29 56.38 Favored 'General case' 0 CA--C 1.471 -2.09 0 N-CA-C 107.599 -1.26 . . . . 58.27 107.599 167.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -153.37 103.07 2.64 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.884 -1.154 . . . . 58.24 107.884 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -79.9 -5.92 56.47 Favored 'General case' 1 C--O 1.142 -4.572 0 CA-C-N 114.217 -1.356 . . . . 79.69 114.007 -173.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 7.7 p -88.2 21.69 2.71 Favored 'General case' 1 C--O 1.152 -4.071 0 O-C-N 119.485 -2.009 . . . . 68.15 115.643 176.985 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 68.0 mt -103.82 -4.79 23.11 Favored 'General case' 0 CA--C 1.48 -1.732 0 O-C-N 117.116 -3.49 . . . . 71.19 106.062 -167.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . 0.269 1.6 mtp85 -143.92 148.9 36.04 Favored 'General case' 0 N--CA 1.4 -2.967 0 CA-C-O 118.522 -0.752 . . . . 77.77 110.09 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.44 -21.28 21.98 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 115.535 1.68 . . . . 98.55 115.535 179.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -78.77 -166.06 0.83 Allowed 'General case' 0 C--O 1.276 2.468 0 N-CA-C 120.211 3.411 . . . . 87.85 120.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.97 -5.13 86.7 Favored Glycine 0 CA--C 1.562 2.991 0 O-C-N 121.406 -0.809 . . . . 87.92 114.718 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -94.07 14.19 20.66 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 113.328 0.862 . . . . 89.37 113.328 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -23.95 61.15 Favored 'General case' 0 C--O 1.275 2.433 0 N-CA-C 115.625 1.713 . . . . 95.6 115.625 -170.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . 0.293 1.2 m-20 -67.92 -13.37 62.11 Favored 'General case' 0 C--O 1.188 -2.184 0 C-N-CA 126.686 1.994 . . . . 103.36 114.819 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' CYS . . . . . . . . . . . . . 78.3 m -90.99 21.03 4.42 Favored 'General case' 0 CA--C 1.462 -2.425 0 N-CA-C 118.585 2.809 . . . . 66.57 118.585 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' CYS . . . . . . . . . . . . . 92.5 m -120.76 141.19 50.71 Favored 'General case' 0 N--CA 1.386 -3.648 0 N-CA-C 114.98 1.474 . . . . 57.56 114.98 -166.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -148.87 158.58 44.27 Favored 'General case' 0 N--CA 1.424 -1.736 0 C-N-CA 128.543 2.737 . . . . 49.96 109.49 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -132.84 148.47 52.31 Favored 'General case' 1 N--CA 1.379 -4.006 0 CA-C-N 111.961 -2.381 . . . . 58.49 112.505 -179.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' ILE . . . . . . . . . . . . . 79.7 mt -119.87 104.08 15.11 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.662 0 CA-C-N 111.367 -2.652 . . . . 52.69 105.934 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' CYS . . . . . . . . . . . . . 37.4 m -81.45 107.34 14.14 Favored 'General case' 1 CA--C 1.632 4.125 0 CA-C-N 112.338 -2.21 . . . . 78.5 115.123 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' ALA . . . . . . . . . . . . 0.349 . . -52.33 152.04 6.61 Favored Pre-proline 0 CA--C 1.619 3.607 0 N-CA-C 120.045 3.35 . . . . 83.55 120.045 154.437 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -68.45 -48.09 1.27 Allowed 'Trans proline' 1 N--CA 1.565 5.697 0 C-N-CA 123.003 2.469 . . . . 90.93 117.535 168.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -51.64 26.13 0.0 OUTLIER 'General case' 1 C--O 1.307 4.088 0 C-N-CA 129.757 3.223 . . . . 105.32 116.161 159.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' LYS . . . . . 1.594 ' CG ' ' CD ' ' A' ' 194' ' ' LYS 0.446 0.0 OUTLIER 34.86 48.35 0.32 Allowed 'General case' 1 CA--C 1.711 7.159 0 N-CA-C 121.741 3.978 . . . . 97.08 121.741 -166.118 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.93 127.83 51.45 Favored 'General case' 1 C--O 1.118 -5.852 0 O-C-N 117.735 -3.103 . . . . 87.4 111.365 174.657 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ILE . . . . . . . . . . . . . 95.8 mt -125.15 129.37 73.24 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.644 0 CA-C-N 124.086 3.13 . . . . 56.76 111.219 -172.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -104.71 126.94 52.29 Favored 'General case' 0 C--O 1.173 -2.935 0 N-CA-C 108.934 -0.765 . . . . 69.05 108.934 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -106.83 132.0 53.29 Favored 'General case' 0 C--O 1.185 -2.325 0 C-N-CA 124.321 1.048 . . . . 50.57 111.008 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.76 148.52 43.31 Favored 'General case' 0 C--O 1.302 3.86 0 N-CA-C 120.269 3.433 . . . . 46.12 120.269 168.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.5 m -114.29 127.96 56.13 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 123.841 1.781 . . . . 52.99 112.752 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -99.15 175.3 5.94 Favored 'General case' 2 C--O 1.094 -7.112 0 N-CA-C 103.924 -2.621 . . . . 56.12 103.924 -171.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -85.71 -9.44 57.17 Favored 'General case' 0 C--O 1.157 -3.788 0 O-C-N 119.865 -1.772 . . . . 62.72 109.442 -170.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.3 p -163.89 162.85 16.28 Favored Pre-proline 0 N--CA 1.398 -3.026 0 O-C-N 119.205 -2.184 . . . . 61.88 110.248 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -56.39 -23.99 49.76 Favored 'Trans proline' 0 C--N 1.297 -2.158 0 C-N-CA 117.181 -1.413 . . . . 59.72 114.127 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -84.0 -38.99 20.23 Favored 'General case' 1 C--O 1.133 -5.07 0 N-CA-C 108.234 -1.025 . . . . 69.16 108.234 -173.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -57.62 -40.55 79.41 Favored 'General case' 0 C--O 1.175 -2.838 0 CA-C-N 114.455 -1.248 . . . . 60.22 110.258 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.25 -50.46 46.84 Favored 'General case' 0 N--CA 1.407 -2.577 0 C-N-CA 119.331 -0.947 . . . . 53.36 112.403 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -54.49 -37.62 65.49 Favored 'General case' 0 C--O 1.16 -3.644 0 O-C-N 120.432 -1.417 . . . . 72.55 112.156 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -67.04 -45.85 76.21 Favored 'General case' 1 CA--C 1.636 4.257 0 O-C-N 118.115 -2.866 . . . . 71.22 106.695 -175.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' TRP . . . . . . . . . . . . . 40.7 m95 -56.03 -46.54 78.8 Favored 'General case' 1 N--CA 1.366 -4.646 0 N-CA-C 112.84 0.681 . . . . 51.25 112.84 172.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 36.4 t -69.52 -42.23 80.72 Favored 'Isoleucine or valine' 1 C--O 1.115 -6.001 0 N-CA-C 104.31 -2.478 . . . . 46.34 104.31 -174.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -61.3 -49.64 76.19 Favored 'General case' 0 C--O 1.155 -3.917 0 CA-C-N 122.273 2.306 . . . . 79.12 108.766 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -63.93 -46.44 84.74 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 104.551 -2.388 . . . . 51.26 104.551 -172.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.5 -35.33 75.43 Favored 'General case' 0 C--O 1.161 -3.565 0 CA-C-N 119.234 0.924 . . . . 54.57 110.302 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 21.4 mttm -70.18 -36.37 74.61 Favored 'General case' 0 C--O 1.163 -3.471 0 O-C-N 119.592 -1.942 . . . . 75.43 110.035 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.8 -53.74 54.34 Favored 'General case' 0 C--O 1.255 1.367 0 C-N-CA 125.01 1.324 . . . . 74.84 113.691 173.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' ILE . . . . . . . . . . . . . 35.4 mm -59.83 -36.88 69.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 123.845 0.858 . . . . 61.41 111.657 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 74.9 mt -75.54 -18.77 59.68 Favored 'General case' 0 C--O 1.291 3.287 0 O-C-N 120.325 -1.484 . . . . 79.01 111.216 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . 0.252 1.5 pt20 -138.72 -4.2 1.61 Allowed 'General case' 0 CA--C 1.467 -2.215 0 C-N-CA 115.484 -2.487 . . . . 94.03 113.056 -172.223 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ASP . . . . . 0.521 ' O ' ' CD2' ' A' ' 221' ' ' LEU . 13.1 m-20 -109.33 47.29 0.94 Allowed 'General case' 0 N--CA 1.381 -3.911 0 C-N-CA 113.304 -3.358 . . . . 93.3 113.737 167.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' LEU . . . . . 0.521 ' CD2' ' O ' ' A' ' 220' ' ' ASP . 4.3 mt -144.05 14.68 1.69 Allowed 'General case' 0 C--O 1.297 3.576 0 N-CA-C 105.886 -1.894 . . . . 81.68 105.886 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 C--O 1.307 4.686 1 CA-C-O 107.802 -7.11 . . . . 82.35 118.509 -146.144 . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' PRO . . . . . 1.544 ' CG ' ' CB ' ' B' ' 14' ' ' PRO . 8.0 Cg_endo . . . . . 1 N--CA 1.622 9.069 0 N-CA-C 107.069 -1.935 . . . . 74.39 107.069 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.87 -41.65 98.1 Favored 'General case' 0 C--O 1.186 -2.283 0 N-CA-C 117.283 2.327 . . . . 87.07 117.283 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.55 -38.44 84.15 Favored 'General case' 0 N--CA 1.414 -2.242 0 C-N-CA 125.645 1.578 . . . . 74.64 108.862 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.3 mm -69.08 -48.1 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-O 116.956 -1.497 . . . . 53.35 111.993 173.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . 0.261 81.0 mtm-85 -64.92 -25.85 68.06 Favored 'General case' 0 C--O 1.175 -2.861 0 C-N-CA 118.083 -1.447 . . . . 54.88 114.635 175.619 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -66.77 -39.08 87.72 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 118.797 -2.439 . . . . 53.41 113.03 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 63.8 tp -66.33 -48.85 68.93 Favored 'General case' 0 CA--C 1.447 -3.009 0 CA-C-O 117.807 -1.092 . . . . 47.67 108.474 175.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.85 -29.09 69.3 Favored 'General case' 0 C--O 1.174 -2.903 0 N-CA-C 113.291 0.848 . . . . 45.54 113.291 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.81 -48.72 70.77 Favored 'General case' 0 N--CA 1.407 -2.59 0 C-N-CA 119.667 -0.813 . . . . 44.56 110.676 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ASP . . . . . 0.506 ' OD2' ' NZ ' ' A' ' 51' ' ' LYS . 86.8 m-20 -59.3 -35.76 74.37 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 118.088 -1.445 . . . . 56.22 114.546 175.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.5 t -58.79 -56.57 15.89 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.304 0 CA-C-N 115.666 -0.697 . . . . 46.98 111.502 176.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.94 -36.29 74.55 Favored 'General case' 0 CA--C 1.591 2.532 0 C-N-CA 125.927 1.691 . . . . 68.31 108.489 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.8 m -68.93 -42.29 76.97 Favored 'General case' 1 C--O 1.139 -4.759 0 O-C-N 120.445 -1.409 . . . . 57.55 109.696 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.66 -60.29 2.66 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 124.142 0.977 . . . . 55.19 108.447 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 95.7 t -61.78 -46.96 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.997 0 N-CA-C 108.594 -0.891 . . . . 57.98 108.594 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.47 -34.02 25.49 Favored 'General case' 0 C--O 1.179 -2.618 0 C-N-CA 117.458 -1.697 . . . . 63.93 111.996 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -108.53 -54.98 2.44 Favored 'General case' 0 N--CA 1.522 3.134 0 O-C-N 118.881 -2.387 . . . . 76.54 115.95 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 14.4 m -54.27 -39.65 67.07 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 119.731 -1.856 . . . . 66.72 112.727 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 29.8 mt -85.18 -8.88 58.38 Favored 'General case' 0 N--CA 1.382 -3.825 0 O-C-N 119.964 -1.71 . . . . 66.35 110.803 -172.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tttt -60.45 134.02 56.66 Favored 'General case' 1 C--O 1.334 5.547 0 O-C-N 119.643 -1.911 . . . . 85.49 112.704 178.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 41.26 63.01 1.67 Allowed Glycine 0 C--N 1.347 1.165 0 O-C-N 128.639 3.712 . . . . 75.89 116.372 -167.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . 0.589 ' OE2' ' OG ' ' A' ' 38' ' ' SER . 28.5 mm-40 -115.73 160.77 19.65 Favored 'General case' 0 N--CA 1.436 -1.171 1 N-CA-C 99.506 -4.257 . . . . 76.74 99.506 177.159 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 66.35 4.35 Favored 'General case' 0 N--CA 1.392 -3.336 0 N-CA-C 119.167 3.025 . . . . 86.68 119.167 -175.076 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 33.8 mt -97.54 147.66 24.04 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.754 -0.832 . . . . 72.37 108.754 -158.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' SER . . . . . 0.423 ' OG ' ' OE2' ' A' ' 35' ' ' GLU . 4.1 p -75.29 176.4 7.44 Favored 'General case' 0 N--CA 1.395 -3.18 0 CA-C-N 119.455 1.025 . . . . 73.35 109.952 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -55.76 30.87 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 117.365 -1.302 . . . . 97.77 108.836 -174.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.75 -38.91 73.08 Favored 'General case' 0 CA--C 1.622 3.723 0 C-N-CA 127.761 2.424 . . . . 102.91 112.027 177.604 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -69.07 -33.56 73.74 Favored 'General case' 0 N--CA 1.404 -2.73 0 O-C-N 118.965 -2.335 . . . . 70.96 109.634 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 16.5 mttp -70.62 -33.08 70.63 Favored 'General case' 1 C--O 1.137 -4.868 0 C-N-CA 119.645 -0.822 . . . . 85.19 110.819 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -82.51 -39.15 22.82 Favored 'General case' 0 CA--C 1.432 -3.571 0 N-CA-C 104.475 -2.416 . . . . 87.86 104.475 -162.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -71.49 -35.89 70.95 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 127.917 3.26 . . . . 82.65 109.708 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -56.21 -47.79 77.71 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 117.534 -1.666 . . . . 61.46 112.05 173.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.73 -37.35 79.38 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.286 -0.87 . . . . 90.96 110.435 -171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -68.13 -38.87 82.67 Favored 'General case' 0 CA--C 1.622 3.723 0 CA-C-N 112.601 -2.09 . . . . 57.89 110.034 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -42.67 90.91 Favored 'General case' 0 C--O 1.169 -3.14 0 C-N-CA 125.805 1.642 . . . . 57.91 112.656 169.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ILE . . . . . . . . . . . . . 3.4 mt -51.88 -49.91 35.27 Favored 'Isoleucine or valine' 0 C--O 1.156 -3.85 0 CA-C-N 121.349 1.886 . . . . 57.09 111.72 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -66.83 -37.56 84.74 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 106.155 -1.795 . . . . 88.02 106.155 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.3 -37.17 86.53 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.834 1.79 . . . . 54.91 115.834 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.55 -36.75 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.088 0 O-C-N 124.517 1.136 . . . . 58.87 112.541 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.24 -41.42 81.19 Favored 'General case' 0 C--O 1.169 -3.145 0 O-C-N 120.149 -1.594 . . . . 71.5 112.21 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -41.93 76.52 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 112.857 -3.449 . . . . 82.04 114.709 177.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 3.9 m -69.07 -28.15 38.08 Favored 'Isoleucine or valine' 1 N--CA 1.376 -4.134 0 O-C-N 126.378 2.299 . . . . 60.36 114.356 -178.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -43.82 -37.32 2.72 Favored 'General case' 0 N--CA 1.41 -2.467 0 N-CA-C 107.293 -1.373 . . . . 54.22 107.293 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 56.2 p -66.72 -16.46 64.25 Favored 'General case' 1 C--O 1.133 -5.032 0 CA-C-N 122.192 2.269 . . . . 58.4 113.977 -174.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.297 42.3 t -72.38 -18.74 19.15 Favored 'Isoleucine or valine' 1 C--N 1.239 -4.203 0 O-C-N 117.233 -3.417 . . . . 62.78 112.308 178.699 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -95.49 2.97 54.62 Favored 'General case' 0 N--CA 1.422 -1.847 0 O-C-N 118.127 -2.858 . . . . 56.9 109.941 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.55 -50.91 30.17 Favored 'General case' 0 C--O 1.195 -1.813 0 N-CA-C 116.751 2.13 . . . . 66.62 116.751 172.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLN . . . . . 0.429 ' CB ' ' O ' ' B' ' 226' ' ' HOH . 3.3 mt-30 -45.63 -40.34 8.88 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 122.808 1.29 . . . . 92.81 113.173 175.0 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -56.67 -28.11 60.09 Favored 'General case' 0 CA--C 1.61 3.259 0 O-C-N 119.582 -1.948 . . . . 78.12 114.274 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -101.26 -0.59 35.49 Favored 'General case' 0 C--O 1.166 -3.333 0 CA-C-O 114.739 -2.553 . . . . 63.94 112.206 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 127.188 2.195 . . . . 60.19 113.56 -178.946 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 CA--C 1.557 1.239 0 CA-C-O 125.692 2.663 . . . . 77.48 110.128 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -56.35 151.58 43.86 Favored 'Trans proline' 0 C--O 1.17 -2.878 0 O-C-N 117.815 -1.729 . . . . 80.14 112.054 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_exo -55.17 141.96 79.09 Favored 'Trans proline' 0 C--O 1.17 -2.894 0 CA-C-O 113.871 -2.637 . . . . 75.25 110.472 163.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ILE . . . . . 1.411 ' CG1' ' CD1' ' B' ' 109' ' ' ILE . 27.0 mm -149.22 140.82 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 C-N-CA 127.584 2.354 . . . . 72.71 108.739 174.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.72 155.72 35.36 Favored 'General case' 0 C--O 1.177 -2.748 0 C-N-CA 118.581 -1.247 . . . . 73.55 110.131 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -51.09 -31.03 17.73 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.967 1.842 . . . . 77.91 113.371 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -99.96 -14.2 18.79 Favored 'General case' 1 C--O 1.114 -6.077 0 CA-C-N 113.386 -1.734 . . . . 92.03 109.575 -167.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -94.7 17.03 14.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 120.72 1.6 . . . . 75.63 107.254 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 15.1 mt -82.2 130.71 58.69 Favored Pre-proline 0 N--CA 1.494 1.741 0 C-N-CA 115.182 -2.607 . . . . 64.29 109.052 -172.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -85.13 130.54 4.07 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 124.62 3.547 . . . . 57.74 112.294 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 2.2 t80 68.86 59.1 0.37 Allowed 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 125.375 1.47 . . . . 59.41 109.164 168.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 47.4 t -79.1 101.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.683 0 CA-C-N 114.595 -1.184 . . . . 62.41 111.703 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 72.0 mt -70.48 -38.25 73.12 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.758 0 N-CA-C 113.336 0.865 . . . . 55.45 113.336 -178.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -156.09 150.12 25.31 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 129.277 3.031 . . . . 59.98 111.923 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -164.38 156.4 16.37 Favored 'General case' 1 C--O 1.127 -5.375 0 CA-C-N 114.259 -1.337 . . . . 56.54 109.398 -174.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.85 156.34 9.61 Favored Glycine 1 C--O 1.163 -4.333 0 N-CA-C 115.681 1.032 . . . . 56.54 115.681 -163.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . 0.251 39.4 m-85 -67.26 128.78 37.68 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 115.191 1.552 . . . . 68.26 115.191 160.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 17.1 mt -142.13 157.92 44.34 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.079 -1.452 . . . . 54.49 107.079 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 -88.15 128.47 35.44 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.388 -1.278 . . . . 80.92 111.586 164.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -112.89 144.7 42.0 Favored 'General case' 0 C--O 1.176 -2.778 0 O-C-N 120.159 -1.588 . . . . 73.78 107.841 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . 0.371 56.6 ttp180 -146.42 151.29 37.2 Favored 'General case' 0 C--O 1.197 -1.686 0 C-N-CA 120.461 -0.496 . . . . 62.31 110.239 159.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -90.42 136.51 33.01 Favored 'General case' 0 C--O 1.252 1.205 0 O-C-N 121.072 -1.017 . . . . 56.72 109.818 169.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LYS . . . . . 0.568 ' NZ ' ' O ' ' B' ' 233' ' ' HOH . 78.3 tttt -60.36 -44.35 95.66 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 120.373 -0.531 . . . . 50.23 111.416 -175.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -67.31 -21.35 65.68 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 114.859 1.429 . . . . 51.15 114.859 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -81.86 -39.09 24.44 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 114.734 -2.555 . . . . 58.85 112.394 169.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 97.7 p -54.78 -37.93 66.64 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 125.959 2.037 . . . . 58.44 115.39 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -50.18 -35.21 25.35 Favored 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 115.946 1.832 . . . . 48.3 115.946 169.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 87.4 mt -91.88 -1.32 57.38 Favored 'General case' 1 N--CA 1.376 -4.147 0 O-C-N 120.186 -1.571 . . . . 56.71 108.444 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.19 1.05 55.85 Favored Glycine 0 N--CA 1.411 -3.024 1 N-CA-C 124.256 4.462 . . . . 52.74 124.256 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -72.84 130.97 41.63 Favored 'General case' 0 C--O 1.178 -2.708 0 N-CA-C 103.482 -2.784 . . . . 57.86 103.482 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -97.3 168.44 10.41 Favored 'General case' 0 C--N 1.272 -2.763 0 O-C-N 119.303 -2.123 . . . . 85.74 115.771 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -41.77 139.49 1.2 Allowed 'General case' 1 C--O 1.14 -4.678 0 C-N-CA 126.871 2.068 . . . . 56.37 115.91 169.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -135.05 136.35 42.0 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 119.838 -1.789 . . . . 70.99 109.804 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' LYS . . . . . 1.558 ' CE ' ' CD ' ' B' ' 139' ' ' LYS 0.309 16.3 mmtt -61.17 125.46 23.83 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 123.635 0.585 . . . . 79.95 109.707 173.756 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 87.3 mmt-85 -134.57 137.98 44.21 Favored 'General case' 0 CA--C 1.572 1.797 0 O-C-N 125.255 1.597 . . . . 56.46 110.81 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -78.95 117.29 19.89 Favored 'General case' 0 N--CA 1.411 -2.418 0 N-CA-C 105.854 -1.906 . . . . 62.98 105.854 164.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.08 142.87 46.44 Favored 'General case' 0 C--O 1.183 -2.441 0 O-C-N 125.793 1.933 . . . . 55.58 110.854 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.84 120.71 11.98 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.365 -2.198 . . . . 62.43 111.511 -169.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 47.0 tp -91.68 105.93 18.1 Favored 'General case' 0 C--N 1.273 -2.731 0 CA-C-O 123.798 1.761 . . . . 59.06 111.694 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.9 t -106.73 101.66 11.09 Favored 'General case' 1 C--O 1.151 -4.108 0 CA-C-N 112.273 -2.239 . . . . 55.96 106.926 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm 57.62 -123.16 1.56 Allowed 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 116.302 -1.809 . . . . 68.33 110.197 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' THR . . . . . 0.404 ' OG1' ' O ' ' B' ' 230' ' ' HOH . 1.2 p -95.91 15.07 21.44 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 126.029 1.731 . . . . 72.41 112.843 177.94 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' VAL . . . . . . . . . . . . . 53.7 t -115.45 129.85 71.04 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.199 0 CA-C-N 119.921 1.237 . . . . 57.5 109.129 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -96.49 117.53 31.09 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 114.756 -1.111 . . . . 53.49 109.353 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -111.52 148.93 32.14 Favored 'General case' 0 C--O 1.287 3.048 0 N-CA-C 108.518 -0.919 . . . . 59.8 108.518 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -139.96 140.25 36.29 Favored 'General case' 0 C--O 1.286 3.001 0 C-N-CA 117.998 -1.481 . . . . 51.15 110.927 173.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -132.31 156.97 45.61 Favored 'General case' 0 C--O 1.292 3.313 0 N-CA-C 103.584 -2.747 . . . . 63.26 103.584 -168.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.15 -44.11 97.69 Favored Glycine 0 C--N 1.354 1.544 0 CA-C-O 117.313 -1.826 . . . . 64.38 113.449 168.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 95.0 p -134.97 169.16 17.83 Favored 'General case' 2 N--CA 1.575 5.789 0 CA-C-N 120.06 1.93 . . . . 68.36 114.457 173.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 p30 -60.3 -21.74 62.34 Favored 'General case' 1 C--O 1.151 -4.127 0 N-CA-C 116.812 2.153 . . . . 73.89 116.812 171.125 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -93.7 -1.67 54.88 Favored 'General case' 0 C--O 1.181 -2.512 0 C-N-CA 127.215 2.206 . . . . 88.55 115.12 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -70.75 165.78 22.31 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 117.449 -3.282 . . . . 85.48 113.072 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -95.23 -10.8 29.34 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 127.344 3.45 . . . . 96.43 109.161 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -164.39 141.28 6.45 Favored 'General case' 0 C--N 1.283 -2.286 0 O-C-N 117.878 -3.014 . . . . 87.51 104.226 -165.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 16.7 pm0 -76.17 138.3 40.59 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.324 -2.216 . . . . 65.2 111.074 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -58.9 -28.93 66.64 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 123.449 1.595 . . . . 83.81 112.626 161.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . 172.0 -174.6 45.35 Favored Glycine 0 C--O 1.266 2.119 0 CA-C-O 123.607 1.67 . . . . 55.28 110.08 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.13 160.96 1.81 Allowed 'General case' 0 C--O 1.25 1.095 0 CA-C-N 112.372 -1.914 . . . . 60.2 113.745 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -151.81 141.31 21.63 Favored 'General case' 0 C--O 1.169 -3.173 0 CA-C-O 123.534 1.635 . . . . 51.96 108.729 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -80.61 133.13 35.71 Favored 'General case' 0 N--CA 1.414 -2.242 0 N-CA-C 106.885 -1.524 . . . . 52.59 106.885 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 pt -92.17 1.59 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 115.71 1.744 . . . . 56.41 115.71 -170.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -56.44 128.6 36.85 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 116.507 -2.077 . . . . 64.23 111.1 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . 77.67 15.56 81.17 Favored Glycine 0 C--O 1.191 -2.564 0 N-CA-C 116.179 1.232 . . . . 55.8 116.179 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.41 165.83 13.2 Favored 'General case' 1 C--O 1.148 -4.244 0 N-CA-C 102.113 -3.291 . . . . 58.78 102.113 -174.201 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -117.3 166.4 12.33 Favored 'General case' 0 C--O 1.168 -3.219 0 N-CA-C 114.475 1.287 . . . . 82.44 114.475 160.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 14.4 p -147.1 143.23 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.737 0 O-C-N 124.614 1.196 . . . . 60.08 109.31 -175.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -161.06 152.26 18.85 Favored 'General case' 0 N--CA 1.406 -2.635 0 N-CA-C 114.101 1.149 . . . . 71.66 114.101 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' MET . . . . . . . . . . . . . 86.6 mmm -74.27 147.32 42.47 Favored 'General case' 0 C--O 1.162 -3.54 0 N-CA-C 107.207 -1.405 . . . . 74.52 107.207 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -152.02 95.93 2.14 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 119.475 1.034 . . . . 67.75 109.432 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' ASN . . . . . 0.421 ' C ' ' OD1' ' B' ' 175' ' ' ASN . 39.9 p30 -88.16 11.84 15.26 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 117.658 -1.163 . . . . 86.7 108.114 -172.029 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' THR . . . . . . . . . . . . . 10.7 p -98.66 30.03 3.46 Favored 'General case' 0 C--O 1.165 -3.372 0 N-CA-C 116.204 1.927 . . . . 86.83 116.204 170.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 29.4 mt -119.39 -13.54 9.25 Favored 'General case' 0 C--O 1.201 -1.461 0 CA-C-N 124.669 3.395 . . . . 83.78 110.901 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 39.6 mtp85 -125.85 134.41 51.65 Favored 'General case' 1 C--O 1.321 4.839 0 N-CA-C 115.757 1.762 . . . . 94.32 115.757 172.383 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -84.51 77.97 9.92 Favored 'General case' 0 CA--C 1.588 2.415 0 N-CA-C 104.597 -2.372 . . . . 108.46 104.597 165.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.77 178.27 9.82 Favored 'General case' 0 CA--C 1.444 -3.105 0 N-CA-C 103.357 -2.831 . . . . 106.81 103.357 -168.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.02 -4.34 84.5 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 108.171 -1.971 . . . . 104.27 108.171 165.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -88.41 16.39 6.5 Favored 'General case' 0 C--O 1.2 -1.526 0 C-N-CA 125.789 1.636 . . . . 111.26 113.603 171.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -79.45 -31.18 42.45 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 119.143 3.016 . . . . 111.09 119.143 -168.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.37 -5.05 37.23 Favored 'General case' 0 C--O 1.304 3.933 0 C-N-CA 125.992 1.717 . . . . 108.21 114.018 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' CYS . . . . . . . . . . . . 0.268 1.7 p -116.62 42.59 2.41 Favored 'General case' 0 CA--C 1.571 1.76 1 N-CA-C 125.711 5.449 . . . . 83.12 125.711 174.218 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' CYS . . . . . . . . . . . . . 71.2 m -114.8 160.34 19.55 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.106 -1.861 . . . . 65.09 113.808 168.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -153.73 171.3 19.07 Favored 'General case' 0 C--O 1.197 -1.673 0 CA-C-O 116.894 -1.527 . . . . 53.96 110.133 170.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -132.09 151.51 51.73 Favored 'General case' 1 N--CA 1.367 -4.593 0 C-N-CA 124.278 1.031 . . . . 58.4 109.39 178.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . 73.4 mt -117.1 125.94 74.2 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.177 0 C-N-CA 126.461 1.904 . . . . 55.51 108.276 168.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' CYS . . . . . . . . . . . . . 74.1 m -115.85 117.27 29.73 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-O 122.259 1.028 . . . . 58.24 109.059 -167.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' ALA . . . . . . . . . . . . . . . -79.97 154.13 75.17 Favored Pre-proline 0 N--CA 1.403 -2.781 0 N-CA-C 117.285 2.328 . . . . 53.46 117.285 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -52.13 -40.95 67.62 Favored 'Trans proline' 0 C--O 1.181 -2.362 0 CA-C-O 112.302 -3.291 . . . . 61.34 115.986 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.59 0.86 2.01 Favored 'General case' 0 CA--C 1.56 1.345 0 O-C-N 126.432 2.333 . . . . 86.12 114.43 170.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 86.27 3.81 0.49 Allowed 'General case' 0 C--O 1.16 -3.649 0 CA-C-O 124.068 1.89 . . . . 77.4 115.648 172.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.08 136.92 53.03 Favored 'General case' 0 C--O 1.167 -3.276 0 O-C-N 119.837 -1.789 . . . . 59.31 113.809 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' ILE . . . . . . . . . . . . . 96.1 mt -131.17 127.45 60.64 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-O 123.698 1.713 . . . . 47.68 110.645 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -107.32 119.43 39.38 Favored 'General case' 0 C--N 1.263 -3.172 0 CA-C-O 125.849 2.738 . . . . 59.39 105.57 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -108.68 141.42 40.67 Favored 'General case' 0 C--N 1.268 -2.962 0 O-C-N 119.989 -1.695 . . . . 46.6 106.879 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -131.57 147.75 52.56 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 123.489 1.614 . . . . 54.43 109.357 179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' THR . . . . . . . . . . . . . 76.9 m -112.21 130.21 56.0 Favored 'General case' 0 C--O 1.196 -1.715 0 CA-C-N 113.963 -1.472 . . . . 60.29 109.498 163.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ALA . . . . . . . . . . . . . . . -100.65 173.29 6.61 Favored 'General case' 1 C--O 1.117 -5.875 0 O-C-N 121.449 -0.782 . . . . 68.44 110.87 177.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' ALA . . . . . . . . . . . . . . . -78.54 -10.96 59.92 Favored 'General case' 0 C--O 1.169 -3.159 0 C-N-CA 126.026 1.73 . . . . 73.72 112.322 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 61.4 p -165.0 166.1 11.28 Favored Pre-proline 0 N--CA 1.506 2.334 0 CA-C-N 122.129 2.241 . . . . 72.46 105.567 169.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.24 -29.33 86.29 Favored 'Trans proline' 0 CA--C 1.561 1.826 0 CA-C-O 126.475 2.614 . . . . 73.11 114.89 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -69.66 -42.53 74.07 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 111.903 -2.408 . . . . 98.82 104.988 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -64.61 -43.52 93.49 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 125.413 1.485 . . . . 83.95 109.757 -174.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -55.22 -55.68 28.5 Favored 'General case' 0 N--CA 1.4 -2.95 0 N-CA-C 113.586 0.958 . . . . 64.71 113.586 172.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.14 -34.06 69.86 Favored 'General case' 0 CA--C 1.486 -1.487 0 C-N-CA 123.689 0.795 . . . . 98.21 111.117 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -64.76 -44.64 89.41 Favored 'General case' 0 C--O 1.165 -3.371 0 N-CA-C 114.297 1.221 . . . . 85.31 114.297 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -60.19 -43.58 95.79 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 113.202 0.816 . . . . 58.15 113.202 173.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.31 -50.09 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 CA-C-O 117.516 -1.231 . . . . 53.41 113.835 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -54.49 -51.46 65.0 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 124.849 1.343 . . . . 94.75 110.038 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -60.45 -42.19 95.63 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 113.98 -1.464 . . . . 57.7 110.743 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.49 -42.43 68.07 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 117.224 -1.791 . . . . 59.97 107.928 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -60.93 -39.68 90.34 Favored 'General case' 0 C--O 1.282 2.795 0 CA-C-O 117.371 -1.299 . . . . 79.22 109.306 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -55.48 -50.48 69.79 Favored 'General case' 0 C--O 1.178 -2.686 0 O-C-N 127.103 2.752 . . . . 79.05 116.48 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.74 -42.89 93.44 Favored 'Isoleucine or valine' 1 C--O 1.127 -5.387 0 O-C-N 119.601 -1.937 . . . . 65.25 111.709 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.57 -0.09 7.87 Favored 'General case' 0 C--O 1.195 -1.811 0 CA-C-N 120.588 1.54 . . . . 79.21 109.852 -174.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -134.03 -49.56 0.81 Allowed 'General case' 1 CA--C 1.414 -4.259 0 CA-C-O 117.46 -1.257 . . . . 92.27 113.954 -172.7 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' ASP . . . . . 0.73 ' CB ' ' O ' ' B' ' 231' ' ' HOH 0.279 0.6 OUTLIER -116.85 72.16 0.82 Allowed 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 112.146 -3.822 . . . . 115.37 115.943 177.37 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . 0.286 0.0 OUTLIER -126.26 -56.8 1.42 Allowed 'General case' 0 N--CA 1.4 -2.97 3 CA-C-N 105.364 -5.38 . . . . 96.38 101.164 159.792 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.746 0 CA-C-N 114.693 -1.14 . . . . 95.09 111.581 171.062 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.692 ' O ' ' CG2' ' A' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . 0.738 ' O ' ' CG ' ' A' ' 136' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . 0.656 ' O ' ' C ' ' A' ' 64' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . 0.451 ' O ' ' CD ' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' HOH . . . . . 0.429 ' O ' ' CB ' ' B' ' 61' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HOH . . . . . 0.404 ' O ' ' OG1' ' B' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' HOH . . . . . 0.73 ' O ' ' CB ' ' B' ' 220' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' HOH . . . . . 0.568 ' O ' ' NZ ' ' B' ' 128' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 2 CA--C 1.593 4.942 0 CA-C-O 114.688 -3.284 . . . . 100.84 116.473 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' A' ' 14' ' ' PRO 0.449 0.4 OUTLIER -110.41 89.51 8.83 Favored Pre-proline 2 N--CA 1.603 7.222 0 C-N-CA 130.4 3.48 . . . . 98.3 120.042 146.979 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 13' ' ' SER . 46.8 Cg_exo -53.75 -54.81 4.23 Favored 'Trans proline' 0 N--CA 1.43 -2.224 1 N-CA-C 124.973 4.951 . . . . 85.15 124.973 -133.948 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -50.75 -44.32 58.42 Favored 'General case' 1 CA--C 1.415 -4.213 0 CA-C-N 122.511 2.414 . . . . 80.09 114.969 -172.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.303 2.7 pt-20 -73.07 -21.62 60.74 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 119.69 3.218 . . . . 74.61 119.69 -174.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . 1.624 ' CG1' ' CD1' ' A' ' 17' ' ' ILE . 29.2 mm -79.01 -47.49 22.7 Favored 'Isoleucine or valine' 1 N--CA 1.35 -5.457 0 O-C-N 126.124 2.14 . . . . 51.3 107.596 177.139 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.25 85.3 mtm-85 -60.24 -29.23 68.62 Favored 'General case' 0 C--O 1.278 2.563 0 C-N-CA 115.75 -2.38 . . . . 52.36 115.876 172.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 194' ' ' LYS . 98.0 m-20 -60.1 -42.51 94.84 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 115.863 -0.608 . . . . 54.47 111.776 171.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.52 -45.62 78.91 Favored 'General case' 0 C--O 1.17 -3.079 0 N-CA-C 115.86 1.8 . . . . 47.82 115.86 175.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.74 -34.63 77.22 Favored 'General case' 0 N--CA 1.395 -3.19 0 C-N-CA 118.713 -1.195 . . . . 50.08 110.417 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.53 74.31 Favored 'General case' 0 CA--C 1.586 2.343 0 N-CA-C 114.937 1.458 . . . . 48.8 114.937 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.78 -39.97 95.54 Favored 'General case' 0 C--O 1.287 3.07 0 C-N-CA 123.925 0.89 . . . . 63.26 112.986 172.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.4 t -58.52 -54.63 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 115.868 -0.605 . . . . 47.28 112.003 172.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.94 -41.17 70.71 Favored 'General case' 0 C--O 1.168 -3.236 0 N-CA-C 118.096 2.628 . . . . 58.53 118.096 173.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.2 m -58.72 -53.25 60.52 Favored 'General case' 0 C--O 1.167 -3.276 0 C-N-CA 125.688 1.595 . . . . 54.5 108.457 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -51.48 -65.51 0.54 Allowed 'General case' 0 N--CA 1.395 -3.224 0 N-CA-C 120.269 3.433 . . . . 54.04 120.269 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . 0.478 ' HA ' HD12 ' A' ' 32' ' ' LEU . 20.4 t -62.1 -46.36 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.427 -3.786 0 O-C-N 119.88 -1.762 . . . . 51.04 112.87 178.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.21 -43.73 50.26 Favored 'General case' 0 CA--C 1.619 3.633 0 C-N-CA 116.489 -2.084 . . . . 55.96 114.856 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -103.74 -54.64 2.53 Favored 'General case' 0 C--O 1.289 3.145 0 C-N-CA 117.104 -1.838 . . . . 70.56 115.184 -172.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 57.1 m -48.88 -43.1 38.73 Favored 'General case' 0 N--CA 1.394 -3.263 0 C-N-CA 118.631 -1.228 . . . . 55.77 113.021 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' A' ' 28' ' ' VAL . 48.1 mt -82.75 -8.76 59.57 Favored 'General case' 0 C--O 1.179 -2.65 0 CA-C-O 117.646 -1.169 . . . . 52.26 111.008 -174.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 tttm -69.62 135.83 50.44 Favored 'General case' 0 C--O 1.303 3.906 0 O-C-N 125.467 1.729 . . . . 78.84 108.299 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.88 -17.29 16.93 Favored Glycine 0 N--CA 1.478 1.451 0 CA-C-N 115.259 -0.882 . . . . 62.55 113.888 -171.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' OE2' ' OG ' ' B' ' 38' ' ' SER . 49.6 mm-40 -70.44 161.27 30.84 Favored 'General case' 0 C--O 1.164 -3.433 0 O-C-N 119.235 -2.332 . . . . 67.48 113.157 -174.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -96.52 92.82 6.45 Favored 'General case' 0 C--N 1.282 -2.341 0 O-C-N 118.224 -2.798 . . . . 71.13 108.056 -169.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.8 mt -111.04 154.51 24.1 Favored 'General case' 0 C--O 1.264 1.856 0 C-N-CA 118.736 -1.185 . . . . 68.39 110.563 -166.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -55.99 170.07 0.33 Allowed 'General case' 0 CA--C 1.485 -1.525 0 N-CA-C 107.316 -1.364 . . . . 71.56 107.316 171.964 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.4 tttp -75.22 -29.92 60.42 Favored 'General case' 0 CA--C 1.593 2.629 0 N-CA-C 109.07 -0.715 . . . . 90.41 109.07 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.495 ' HD3' ' O ' ' A' ' 232' ' ' HOH . 14.5 tttm -73.46 -57.55 3.93 Favored 'General case' 1 N--CA 1.377 -4.087 0 N-CA-C 102.226 -3.25 . . . . 88.15 102.226 -173.761 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.55 -31.81 25.74 Favored 'General case' 0 CA--C 1.582 2.211 0 CA-C-O 117.935 -1.031 . . . . 67.46 113.685 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 34.0 mttt -70.75 -37.05 73.4 Favored 'General case' 0 C--O 1.156 -3.855 0 CA-C-N 120.071 1.305 . . . . 82.16 108.942 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -78.29 -37.78 44.07 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 105.097 -2.186 . . . . 86.78 105.097 -167.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -69.73 -33.51 72.57 Favored 'General case' 0 C--O 1.182 -2.473 0 N-CA-C 117.769 2.507 . . . . 73.22 117.769 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.7 ttt-85 -63.72 -30.33 71.44 Favored 'General case' 1 N--CA 1.366 -4.634 0 CA-C-N 115.425 -0.807 . . . . 59.38 110.972 173.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 2.1 mm-40 -81.77 -43.91 17.72 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 102.835 -3.024 . . . . 92.91 102.835 -168.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -46.5 -55.35 7.65 Favored 'General case' 0 N--CA 1.396 -3.174 0 N-CA-C 118.356 2.725 . . . . 58.91 118.356 166.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.34 -37.15 84.53 Favored 'General case' 1 N--CA 1.365 -4.681 0 CA-C-O 116.272 -1.823 . . . . 61.13 108.208 -174.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.6 -42.87 89.66 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.713 0 O-C-N 124.713 1.258 . . . . 48.72 111.344 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -63.56 -47.33 81.97 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.875 1.359 . . . . 77.51 108.66 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . 0.446 ' NZ ' ' OD2' ' B' ' 23' ' ' ASP . 85.2 mttt -59.81 -38.19 81.27 Favored 'General case' 0 C--O 1.17 -3.124 0 N-CA-C 115.228 1.566 . . . . 53.89 115.228 177.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -59.6 -43.2 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.414 0 CA-C-O 122.678 1.228 . . . . 50.59 113.276 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . 0.318 69.2 mttt -57.78 -44.1 85.98 Favored 'General case' 0 C--O 1.259 1.586 0 CA-C-N 111.674 -2.512 . . . . 73.69 115.974 175.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -78.71 -25.61 44.69 Favored 'General case' 1 C--O 1.139 -4.719 0 N-CA-C 106.641 -1.614 . . . . 77.69 106.641 -170.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . 0.515 ' O ' ' HB ' ' A' ' 58' ' ' VAL . 0.3 OUTLIER -73.81 -14.55 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.453 0 CA-C-N 122.493 2.406 . . . . 50.4 110.554 -171.239 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 mttt -64.2 -26.2 68.41 Favored 'General case' 0 C--O 1.192 -1.937 0 C-N-CA 126.139 1.775 . . . . 51.51 112.312 -172.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 p -72.95 -8.64 56.57 Favored 'General case' 0 CA--C 1.427 -3.773 0 CA-C-O 124.41 2.052 . . . . 53.98 114.099 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 55' ' ' VAL . 0.5 OUTLIER -77.54 -24.84 14.68 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.698 0 CA-C-N 113.205 -1.816 . . . . 55.87 110.336 -174.257 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -94.14 8.03 43.1 Favored 'General case' 1 N--CA 1.365 -4.677 0 O-C-N 120.156 -1.59 . . . . 51.55 108.018 -173.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.61 -55.14 17.7 Favored 'General case' 0 CA--C 1.472 -2.055 0 N-CA-C 119.053 2.983 . . . . 60.69 119.053 171.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 230' ' ' HOH . 64.7 mt-30 -52.13 -26.85 12.25 Favored 'General case' 0 C--O 1.191 -1.988 0 C-N-CA 126.096 1.758 . . . . 96.23 111.747 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -66.1 -30.94 71.53 Favored 'General case' 0 CA--C 1.448 -2.97 0 O-C-N 121.484 -0.76 . . . . 72.95 112.134 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -99.14 0.42 43.42 Favored 'General case' 1 C--O 1.132 -5.121 0 CA-C-O 115.344 -2.265 . . . . 57.86 112.393 -174.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . 0.656 ' C ' ' O ' ' A' ' 231' ' ' HOH . 91.4 mt-30 . . . . . 0 N--CA 1.501 2.112 0 C-N-CA 130.453 3.501 . . . . 60.71 116.753 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 CA--C 1.477 -1.842 0 N-CA-C 114.157 1.169 . . . . 76.98 114.157 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -71.62 150.89 57.69 Favored 'Trans proline' 0 C--O 1.166 -3.098 0 N-CA-C 118.873 2.605 . . . . 74.95 118.873 -178.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.23 149.53 84.85 Favored 'Trans proline' 0 C--O 1.197 -1.542 0 CA-C-N 121.715 1.648 . . . . 70.63 112.679 175.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.1 tt -159.64 138.55 3.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 C-N-CA 125.58 1.552 . . . . 63.59 109.815 -175.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.88 153.58 39.79 Favored 'General case' 0 C--O 1.17 -3.124 0 O-C-N 120.553 -1.342 . . . . 64.22 111.685 -175.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -48.1 -49.03 33.27 Favored 'General case' 0 C--O 1.178 -2.7 0 O-C-N 119.995 -1.691 . . . . 60.54 114.421 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -80.48 -3.39 49.8 Favored 'General case' 0 C--O 1.17 -3.126 0 C-N-CA 125.883 1.673 . . . . 85.08 113.241 -171.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -106.48 1.89 25.87 Favored 'General case' 0 N--CA 1.407 -2.599 0 CA-C-N 119.928 1.24 . . . . 72.08 113.835 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 14.1 mt -60.48 124.42 78.37 Favored Pre-proline 0 CA--C 1.485 -1.543 0 CA-C-N 120.167 1.348 . . . . 63.97 109.392 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.4 160.85 35.25 Favored 'Trans proline' 1 CA--C 1.63 5.29 0 O-C-N 123.06 1.032 . . . . 50.67 114.021 174.258 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 5.5 t80 39.05 58.83 1.76 Allowed 'General case' 0 C--O 1.283 2.827 0 C-N-CA 126.079 1.752 . . . . 49.71 110.33 170.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 84.2 t -79.07 98.45 2.83 Favored 'Isoleucine or valine' 1 C--O 1.143 -4.52 0 CA-C-N 114.687 -1.142 . . . . 47.35 109.116 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 94.0 mt -69.51 -32.97 54.93 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.717 0 CA-C-O 116.605 -1.664 . . . . 50.13 115.152 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.9 tttp -159.33 142.76 14.61 Favored 'General case' 1 N--CA 1.358 -5.075 0 CA-C-O 123.937 1.827 . . . . 49.03 111.212 173.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -145.1 161.21 40.02 Favored 'General case' 1 C--O 1.124 -5.514 0 C-N-CA 116.798 -1.961 . . . . 51.38 105.847 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.96 165.89 25.13 Favored Glycine 0 N--CA 1.405 -3.367 0 CA-C-O 118.169 -1.351 . . . . 50.64 111.59 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -79.08 131.2 36.18 Favored 'General case' 0 C--O 1.186 -2.268 0 CA-C-O 122.105 0.955 . . . . 53.93 112.57 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 33.7 mt -135.52 158.3 44.72 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.785 -0.821 . . . . 50.19 108.785 175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -89.14 147.44 24.2 Favored 'General case' 0 N--CA 1.534 3.747 0 C-N-CA 114.61 -2.836 . . . . 78.23 110.379 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -137.48 151.38 48.41 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 103.659 -2.719 . . . . 75.34 103.659 -166.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . 0.42 ' CZ ' ' OG ' ' A' ' 131' ' ' SER . 46.4 ttp180 -169.13 130.16 1.14 Allowed 'General case' 0 N--CA 1.424 -1.756 0 N-CA-C 105.821 -1.918 . . . . 68.7 105.821 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -73.5 142.02 46.78 Favored 'General case' 0 CA--C 1.615 3.474 0 CA-C-O 122.048 0.928 . . . . 64.35 112.226 168.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -58.16 -37.83 75.44 Favored 'General case' 1 CA--C 1.419 -4.082 0 CA-C-N 114.17 -1.377 . . . . 60.49 112.828 -179.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.83 -11.51 59.58 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.076 -1.049 . . . . 56.28 110.57 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -85.38 -33.94 21.88 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 124.066 1.889 . . . . 50.77 114.646 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' SER . . . . . 0.42 ' OG ' ' CZ ' ' A' ' 126' ' ' ARG . 0.6 OUTLIER -57.05 -47.64 80.46 Favored 'General case' 0 C--N 1.27 -2.875 0 C-N-CA 126.417 1.887 . . . . 56.27 115.109 174.811 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -49.39 -34.28 15.86 Favored 'General case' 0 N--CA 1.384 -3.747 0 N-CA-C 114.596 1.332 . . . . 46.09 114.596 169.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 94.1 mt -89.58 0.13 57.13 Favored 'General case' 0 N--CA 1.51 2.556 0 CA-C-N 115.789 -0.642 . . . . 48.64 111.401 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.2 14.33 64.42 Favored Glycine 0 N--CA 1.417 -2.627 0 N-CA-C 120.118 2.807 . . . . 50.97 120.118 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -69.47 140.29 54.0 Favored 'General case' 0 C--O 1.165 -3.343 0 CA-C-N 118.205 1.003 . . . . 63.6 111.252 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . 1.524 ' CG ' ' CD ' ' A' ' 136' ' ' GLU 0.255 1.1 tt0 -68.44 146.28 53.33 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-O 123.681 1.705 . . . . 96.46 112.346 -179.436 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -52.24 146.14 9.69 Favored 'General case' 0 N--CA 1.401 -2.92 0 O-C-N 119.413 -2.054 . . . . 68.33 111.343 162.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.8 130.13 55.62 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 129.524 3.13 . . . . 81.32 107.544 178.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LYS . . . . . 1.603 ' CD ' ' CE ' ' A' ' 139' ' ' LYS . 0.4 OUTLIER -67.52 128.01 34.85 Favored 'General case' 0 CA--C 1.59 2.5 0 N-CA-C 104.36 -2.459 . . . . 82.17 104.36 174.164 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -139.06 148.59 43.55 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 117.72 -1.592 . . . . 51.87 107.952 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 34.0 t90 -90.58 118.67 30.21 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 102.824 -3.028 . . . . 63.24 102.824 168.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 72.6 m -108.2 140.58 41.22 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.145 -0.934 . . . . 49.66 110.103 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -139.41 133.77 31.48 Favored 'General case' 0 CA--C 1.425 -3.838 0 CA-C-N 114.066 -1.425 . . . . 46.02 113.585 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 50.9 tp -101.99 100.32 10.59 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 125.026 1.454 . . . . 46.57 110.737 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . 0.25 23.2 t -107.44 109.92 21.75 Favored 'General case' 0 C--O 1.268 2.029 0 N-CA-C 106.111 -1.811 . . . . 53.16 106.111 -170.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 27.3 mttt 53.96 -124.52 2.23 Favored 'General case' 1 C--O 1.148 -4.278 0 C-N-CA 116.057 -2.257 . . . . 75.22 112.178 -165.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' THR . . . . . 0.738 HG22 ' O ' ' A' ' 226' ' ' HOH . 1.9 m -97.24 18.37 15.2 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 127.646 2.378 . . . . 61.45 108.659 -178.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 76.4 t -130.72 132.83 64.01 Favored 'Isoleucine or valine' 0 C--O 1.288 3.13 1 O-C-N 116.281 -4.012 . . . . 52.05 108.366 -174.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -95.39 122.12 37.78 Favored 'General case' 1 N--CA 1.376 -4.157 0 O-C-N 127.787 3.179 . . . . 47.23 110.63 -174.13 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -116.6 150.5 37.95 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 118.94 -2.35 . . . . 51.68 112.973 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -135.48 136.81 41.57 Favored 'General case' 0 C--O 1.179 -2.644 0 C-N-CA 117.664 -1.614 . . . . 50.66 111.093 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -130.28 159.51 36.7 Favored 'General case' 0 C--O 1.287 3.043 0 O-C-N 126.295 2.247 . . . . 59.08 112.235 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.46 -49.14 40.09 Favored Glycine 0 C--O 1.195 -2.334 0 N-CA-C 115.939 1.135 . . . . 55.85 115.939 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 60.7 p -152.37 177.48 10.54 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 103.918 -2.623 . . . . 62.24 103.918 172.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -69.84 0.48 5.69 Favored 'General case' 1 C--O 1.312 4.356 0 N-CA-C 117.51 2.411 . . . . 70.02 117.51 177.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -113.3 4.27 16.34 Favored 'General case' 0 C--O 1.18 -2.603 0 CA-C-O 115.248 -2.311 . . . . 89.01 110.685 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.22 161.0 31.06 Favored 'General case' 0 CA--C 1.463 -2.377 0 N-CA-C 106.08 -1.822 . . . . 70.99 106.08 -171.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -101.68 -4.62 26.2 Favored 'General case' 1 C--O 1.137 -4.839 0 CA-C-O 125.696 2.665 . . . . 94.76 106.663 -173.537 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -158.09 148.04 20.07 Favored 'General case' 0 C--N 1.26 -3.316 1 O-C-N 116.027 -4.171 . . . . 90.03 105.895 -174.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -81.72 152.64 26.95 Favored 'General case' 0 C--O 1.265 1.893 0 C-N-CA 124.101 0.961 . . . . 64.89 112.773 -175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 15.5 mmtm -78.81 -17.33 55.88 Favored 'General case' 0 C--O 1.177 -2.737 0 N-CA-C 108.65 -0.87 . . . . 78.27 108.65 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 166.19 160.68 13.79 Favored Glycine 0 C--O 1.29 3.602 1 N-CA-C 101.042 -4.823 . . . . 57.41 101.042 -165.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.81 169.37 24.51 Favored 'General case' 1 C--O 1.092 -7.187 0 CA-C-O 123.638 1.685 . . . . 62.77 112.126 169.338 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -157.68 142.58 16.67 Favored 'General case' 0 C--N 1.267 -2.998 0 O-C-N 117.44 -3.287 . . . . 53.39 109.679 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.43 129.7 37.74 Favored 'General case' 0 C--O 1.18 -2.559 0 C-N-CA 126.108 1.763 . . . . 51.45 108.629 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ILE . . . . . 0.402 ' O ' ' C ' ' A' ' 167' ' ' ASP . 28.1 pt -84.72 -10.06 11.49 Favored 'Isoleucine or valine' 1 C--O 1.125 -5.459 0 N-CA-C 116.105 1.891 . . . . 54.31 116.105 -173.692 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASP . . . . . 0.402 ' C ' ' O ' ' A' ' 166' ' ' ILE . 15.3 t70 -42.12 122.71 2.21 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 120.018 1.281 . . . . 61.92 112.714 172.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.68 -3.95 78.75 Favored Glycine 0 C--O 1.252 1.255 0 C-N-CA 117.602 -2.237 . . . . 59.25 115.879 173.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' TYR . . . . . 0.412 ' CE2' ' HB2' ' A' ' 191' ' ' ALA . 9.8 m-85 -87.35 161.14 18.08 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 105.518 -2.031 . . . . 79.1 105.518 -176.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -114.36 157.84 22.28 Favored 'General case' 0 N--CA 1.393 -3.294 0 O-C-N 120.06 -1.65 . . . . 81.84 110.717 164.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.9 p -135.41 145.8 31.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 121.527 0.679 . . . . 55.06 111.267 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -158.07 156.36 30.89 Favored 'General case' 0 C--O 1.165 -3.383 0 N-CA-C 118.801 2.889 . . . . 73.93 118.801 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 78.5 mmm -65.34 145.29 56.38 Favored 'General case' 0 CA--C 1.471 -2.09 0 N-CA-C 107.599 -1.26 . . . . 58.27 107.599 167.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -153.37 103.07 2.64 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.884 -1.154 . . . . 58.24 107.884 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -79.9 -5.92 56.47 Favored 'General case' 1 C--O 1.142 -4.572 0 CA-C-N 114.217 -1.356 . . . . 79.69 114.007 -173.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 7.7 p -88.2 21.69 2.71 Favored 'General case' 1 C--O 1.152 -4.071 0 O-C-N 119.485 -2.009 . . . . 68.15 115.643 176.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 68.0 mt -103.82 -4.79 23.11 Favored 'General case' 0 CA--C 1.48 -1.732 0 O-C-N 117.116 -3.49 . . . . 71.19 106.062 -167.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . 0.269 1.6 mtp85 -143.92 148.9 36.04 Favored 'General case' 0 N--CA 1.4 -2.967 0 CA-C-O 118.522 -0.752 . . . . 77.77 110.09 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.44 -21.28 21.98 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 115.535 1.68 . . . . 98.55 115.535 179.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -78.77 -166.06 0.83 Allowed 'General case' 0 C--O 1.276 2.468 0 N-CA-C 120.211 3.411 . . . . 87.85 120.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.97 -5.13 86.7 Favored Glycine 0 CA--C 1.562 2.991 0 O-C-N 121.406 -0.809 . . . . 87.92 114.718 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -94.07 14.19 20.66 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 113.328 0.862 . . . . 89.37 113.328 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -23.95 61.15 Favored 'General case' 0 C--O 1.275 2.433 0 N-CA-C 115.625 1.713 . . . . 95.6 115.625 -170.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . 0.293 1.2 m-20 -67.92 -13.37 62.11 Favored 'General case' 0 C--O 1.188 -2.184 0 C-N-CA 126.686 1.994 . . . . 103.36 114.819 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 185' ' ' CYS . . . . . . . . . . . . . 78.3 m -90.99 21.03 4.42 Favored 'General case' 0 CA--C 1.462 -2.425 0 N-CA-C 118.585 2.809 . . . . 66.57 118.585 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' CYS . . . . . . . . . . . . . 92.5 m -120.76 141.19 50.71 Favored 'General case' 0 N--CA 1.386 -3.648 0 N-CA-C 114.98 1.474 . . . . 57.56 114.98 -166.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -148.87 158.58 44.27 Favored 'General case' 0 N--CA 1.424 -1.736 0 C-N-CA 128.543 2.737 . . . . 49.96 109.49 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -132.84 148.47 52.31 Favored 'General case' 1 N--CA 1.379 -4.006 0 CA-C-N 111.961 -2.381 . . . . 58.49 112.505 -179.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 189' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 199' ' ' PHE . 79.7 mt -119.87 104.08 15.11 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.662 0 CA-C-N 111.367 -2.652 . . . . 52.69 105.934 -178.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 190' ' ' CYS . . . . . . . . . . . . . 37.4 m -81.45 107.34 14.14 Favored 'General case' 1 CA--C 1.632 4.125 0 CA-C-N 112.338 -2.21 . . . . 78.5 115.123 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' ALA . . . . . 0.412 ' HB2' ' CE2' ' A' ' 169' ' ' TYR 0.349 . . -52.33 152.04 6.61 Favored Pre-proline 0 CA--C 1.619 3.607 0 N-CA-C 120.045 3.35 . . . . 83.55 120.045 154.437 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 192' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -68.45 -48.09 1.27 Allowed 'Trans proline' 1 N--CA 1.565 5.697 0 C-N-CA 123.003 2.469 . . . . 90.93 117.535 168.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -51.64 26.13 0.0 OUTLIER 'General case' 1 C--O 1.307 4.088 0 C-N-CA 129.757 3.223 . . . . 105.32 116.161 159.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 194' ' ' LYS . . . . . 1.594 ' CG ' ' CD ' ' A' ' 194' ' ' LYS 0.446 0.0 OUTLIER 34.86 48.35 0.32 Allowed 'General case' 1 CA--C 1.711 7.159 0 N-CA-C 121.741 3.978 . . . . 97.08 121.741 -166.118 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.93 127.83 51.45 Favored 'General case' 1 C--O 1.118 -5.852 0 O-C-N 117.735 -3.103 . . . . 87.4 111.365 174.657 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ILE . . . . . . . . . . . . . 95.8 mt -125.15 129.37 73.24 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.644 0 CA-C-N 124.086 3.13 . . . . 56.76 111.219 -172.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -104.71 126.94 52.29 Favored 'General case' 0 C--O 1.173 -2.935 0 N-CA-C 108.934 -0.765 . . . . 69.05 108.934 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -106.83 132.0 53.29 Favored 'General case' 0 C--O 1.185 -2.325 0 C-N-CA 124.321 1.048 . . . . 50.57 111.008 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 189' ' ' ILE . 18.9 m-85 -119.76 148.52 43.31 Favored 'General case' 0 C--O 1.302 3.86 0 N-CA-C 120.269 3.433 . . . . 46.12 120.269 168.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.5 m -114.29 127.96 56.13 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 123.841 1.781 . . . . 52.99 112.752 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -99.15 175.3 5.94 Favored 'General case' 2 C--O 1.094 -7.112 0 N-CA-C 103.924 -2.621 . . . . 56.12 103.924 -171.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -85.71 -9.44 57.17 Favored 'General case' 0 C--O 1.157 -3.788 0 O-C-N 119.865 -1.772 . . . . 62.72 109.442 -170.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.3 p -163.89 162.85 16.28 Favored Pre-proline 0 N--CA 1.398 -3.026 0 O-C-N 119.205 -2.184 . . . . 61.88 110.248 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' PRO . . . . . 0.722 ' O ' ' HG3' ' A' ' 208' ' ' GLU . 66.3 Cg_exo -56.39 -23.99 49.76 Favored 'Trans proline' 0 C--N 1.297 -2.158 0 C-N-CA 117.181 -1.413 . . . . 59.72 114.127 177.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -84.0 -38.99 20.23 Favored 'General case' 1 C--O 1.133 -5.07 0 N-CA-C 108.234 -1.025 . . . . 69.16 108.234 -173.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -57.62 -40.55 79.41 Favored 'General case' 0 C--O 1.175 -2.838 0 CA-C-N 114.455 -1.248 . . . . 60.22 110.258 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.25 -50.46 46.84 Favored 'General case' 0 N--CA 1.407 -2.577 0 C-N-CA 119.331 -0.947 . . . . 53.36 112.403 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' GLU . . . . . 0.722 ' HG3' ' O ' ' A' ' 204' ' ' PRO . 63.1 mt-10 -54.49 -37.62 65.49 Favored 'General case' 0 C--O 1.16 -3.644 0 O-C-N 120.432 -1.417 . . . . 72.55 112.156 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -67.04 -45.85 76.21 Favored 'General case' 1 CA--C 1.636 4.257 0 O-C-N 118.115 -2.866 . . . . 71.22 106.695 -175.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 210' ' ' TRP . . . . . . . . . . . . . 40.7 m95 -56.03 -46.54 78.8 Favored 'General case' 1 N--CA 1.366 -4.646 0 N-CA-C 112.84 0.681 . . . . 51.25 112.84 172.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 36.4 t -69.52 -42.23 80.72 Favored 'Isoleucine or valine' 1 C--O 1.115 -6.001 0 N-CA-C 104.31 -2.478 . . . . 46.34 104.31 -174.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -61.3 -49.64 76.19 Favored 'General case' 0 C--O 1.155 -3.917 0 CA-C-N 122.273 2.306 . . . . 79.12 108.766 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -63.93 -46.44 84.74 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 104.551 -2.388 . . . . 51.26 104.551 -172.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.5 -35.33 75.43 Favored 'General case' 0 C--O 1.161 -3.565 0 CA-C-N 119.234 0.924 . . . . 54.57 110.302 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 21.4 mttm -70.18 -36.37 74.61 Favored 'General case' 0 C--O 1.163 -3.471 0 O-C-N 119.592 -1.942 . . . . 75.43 110.035 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.8 -53.74 54.34 Favored 'General case' 0 C--O 1.255 1.367 0 C-N-CA 125.01 1.324 . . . . 74.84 113.691 173.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' ILE . . . . . 0.405 HD12 HG23 ' A' ' 217' ' ' ILE . 35.4 mm -59.83 -36.88 69.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 123.845 0.858 . . . . 61.41 111.657 174.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 74.9 mt -75.54 -18.77 59.68 Favored 'General case' 0 C--O 1.291 3.287 0 O-C-N 120.325 -1.484 . . . . 79.01 111.216 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . 0.252 8.2 pt20 -138.72 -4.2 1.61 Allowed 'General case' 0 CA--C 1.467 -2.215 0 C-N-CA 115.484 -2.487 . . . . 94.03 113.056 -172.223 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ASP . . . . . 0.954 ' O ' HD23 ' A' ' 221' ' ' LEU . 13.1 m-20 -109.33 47.29 0.94 Allowed 'General case' 0 N--CA 1.381 -3.911 0 C-N-CA 113.304 -3.358 . . . . 93.3 113.737 167.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 221' ' ' LEU . . . . . 0.954 HD23 ' O ' ' A' ' 220' ' ' ASP . 4.3 mt -144.05 14.68 1.69 Allowed 'General case' 0 C--O 1.297 3.576 0 N-CA-C 105.886 -1.894 . . . . 81.68 105.886 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 C--O 1.307 4.686 1 CA-C-O 107.802 -7.11 . . . . 82.35 118.509 -146.144 . . . . . . . . 2 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' PRO . . . . . 1.544 ' CG ' ' CB ' ' B' ' 14' ' ' PRO . 8.0 Cg_endo . . . . . 1 N--CA 1.622 9.069 0 N-CA-C 107.069 -1.935 . . . . 74.39 107.069 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.87 -41.65 98.1 Favored 'General case' 0 C--O 1.186 -2.283 0 N-CA-C 117.283 2.327 . . . . 87.07 117.283 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.55 -38.44 84.15 Favored 'General case' 0 N--CA 1.414 -2.242 0 C-N-CA 125.645 1.578 . . . . 74.64 108.862 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.3 mm -69.08 -48.1 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-O 116.956 -1.497 . . . . 53.35 111.993 173.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . 0.261 81.0 mtm-85 -64.92 -25.85 68.06 Favored 'General case' 0 C--O 1.175 -2.861 0 C-N-CA 118.083 -1.447 . . . . 54.88 114.635 175.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -66.77 -39.08 87.72 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 118.797 -2.439 . . . . 53.41 113.03 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 63.8 tp -66.33 -48.85 68.93 Favored 'General case' 0 CA--C 1.447 -3.009 0 CA-C-O 117.807 -1.092 . . . . 47.67 108.474 175.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.85 -29.09 69.3 Favored 'General case' 0 C--O 1.174 -2.903 0 N-CA-C 113.291 0.848 . . . . 45.54 113.291 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.81 -48.72 70.77 Favored 'General case' 0 N--CA 1.407 -2.59 0 C-N-CA 119.667 -0.813 . . . . 44.56 110.676 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' NZ ' ' A' ' 51' ' ' LYS . 86.8 m-20 -59.3 -35.76 74.37 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 118.088 -1.445 . . . . 56.22 114.546 175.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.5 t -58.79 -56.57 15.89 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.304 0 CA-C-N 115.666 -0.697 . . . . 46.98 111.502 176.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.94 -36.29 74.55 Favored 'General case' 0 CA--C 1.591 2.532 0 C-N-CA 125.927 1.691 . . . . 68.31 108.489 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.8 m -68.93 -42.29 76.97 Favored 'General case' 1 C--O 1.139 -4.759 0 O-C-N 120.445 -1.409 . . . . 57.55 109.696 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.66 -60.29 2.66 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 124.142 0.977 . . . . 55.19 108.447 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 95.7 t -61.78 -46.96 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.997 0 N-CA-C 108.594 -0.891 . . . . 57.98 108.594 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.47 -34.02 25.49 Favored 'General case' 0 C--O 1.179 -2.618 0 C-N-CA 117.458 -1.697 . . . . 63.93 111.996 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -108.53 -54.98 2.44 Favored 'General case' 0 N--CA 1.522 3.134 0 O-C-N 118.881 -2.387 . . . . 76.54 115.95 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 14.4 m -54.27 -39.65 67.07 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 119.731 -1.856 . . . . 66.72 112.727 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 29.8 mt -85.18 -8.88 58.38 Favored 'General case' 0 N--CA 1.382 -3.825 0 O-C-N 119.964 -1.71 . . . . 66.35 110.803 -172.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tttt -60.45 134.02 56.66 Favored 'General case' 1 C--O 1.334 5.547 0 O-C-N 119.643 -1.911 . . . . 85.49 112.704 178.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 41.26 63.01 1.67 Allowed Glycine 0 C--N 1.347 1.165 0 O-C-N 128.639 3.712 . . . . 75.89 116.372 -167.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . 0.589 ' OE2' ' OG ' ' A' ' 38' ' ' SER . 28.5 mm-40 -115.73 160.77 19.65 Favored 'General case' 0 N--CA 1.436 -1.171 1 N-CA-C 99.506 -4.257 . . . . 76.74 99.506 177.159 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 66.35 4.35 Favored 'General case' 0 N--CA 1.392 -3.336 0 N-CA-C 119.167 3.025 . . . . 86.68 119.167 -175.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 33.8 mt -97.54 147.66 24.04 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.754 -0.832 . . . . 72.37 108.754 -158.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' SER . . . . . 0.423 ' OG ' ' OE2' ' A' ' 35' ' ' GLU . 4.1 p -75.29 176.4 7.44 Favored 'General case' 0 N--CA 1.395 -3.18 0 CA-C-N 119.455 1.025 . . . . 73.35 109.952 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' B' ' 43' ' ' GLU . 0.0 OUTLIER -59.08 -55.76 30.87 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 117.365 -1.302 . . . . 97.77 108.836 -174.84 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . 0.577 ' N ' ' HG2' ' B' ' 39' ' ' LYS . 0.1 OUTLIER -56.75 -38.91 73.08 Favored 'General case' 0 CA--C 1.622 3.723 0 C-N-CA 127.761 2.424 . . . . 102.91 112.027 177.604 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -69.07 -33.56 73.74 Favored 'General case' 0 N--CA 1.404 -2.73 0 O-C-N 118.965 -2.335 . . . . 70.96 109.634 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 16.5 mttp -70.62 -33.08 70.63 Favored 'General case' 1 C--O 1.137 -4.868 0 C-N-CA 119.645 -0.822 . . . . 85.19 110.819 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' B' ' 39' ' ' LYS . 59.5 mt-10 -82.51 -39.15 22.82 Favored 'General case' 0 CA--C 1.432 -3.571 0 N-CA-C 104.475 -2.416 . . . . 87.86 104.475 -162.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -71.49 -35.89 70.95 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 127.917 3.26 . . . . 82.65 109.708 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -56.21 -47.79 77.71 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 117.534 -1.666 . . . . 61.46 112.05 173.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.73 -37.35 79.38 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.286 -0.87 . . . . 90.96 110.435 -171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -68.13 -38.87 82.67 Favored 'General case' 0 CA--C 1.622 3.723 0 CA-C-N 112.601 -2.09 . . . . 57.89 110.034 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -42.67 90.91 Favored 'General case' 0 C--O 1.169 -3.14 0 C-N-CA 125.805 1.642 . . . . 57.91 112.656 169.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ILE . . . . . . . . . . . . . 3.4 mt -51.88 -49.91 35.27 Favored 'Isoleucine or valine' 0 C--O 1.156 -3.85 0 CA-C-N 121.349 1.886 . . . . 57.09 111.72 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -66.83 -37.56 84.74 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 106.155 -1.795 . . . . 88.02 106.155 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.3 -37.17 86.53 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.834 1.79 . . . . 54.91 115.834 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.55 -36.75 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.088 0 O-C-N 124.517 1.136 . . . . 58.87 112.541 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.24 -41.42 81.19 Favored 'General case' 0 C--O 1.169 -3.145 0 O-C-N 120.149 -1.594 . . . . 71.5 112.21 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -41.93 76.52 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 112.857 -3.449 . . . . 82.04 114.709 177.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 3.9 m -69.07 -28.15 38.08 Favored 'Isoleucine or valine' 1 N--CA 1.376 -4.134 0 O-C-N 126.378 2.299 . . . . 60.36 114.356 -178.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -43.82 -37.32 2.72 Favored 'General case' 0 N--CA 1.41 -2.467 0 N-CA-C 107.293 -1.373 . . . . 54.22 107.293 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 56.2 p -66.72 -16.46 64.25 Favored 'General case' 1 C--O 1.133 -5.032 0 CA-C-N 122.192 2.269 . . . . 58.4 113.977 -174.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.297 42.3 t -72.38 -18.74 19.15 Favored 'Isoleucine or valine' 1 C--N 1.239 -4.203 0 O-C-N 117.233 -3.417 . . . . 62.78 112.308 178.699 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -95.49 2.97 54.62 Favored 'General case' 0 N--CA 1.422 -1.847 0 O-C-N 118.127 -2.858 . . . . 56.9 109.941 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.55 -50.91 30.17 Favored 'General case' 0 C--O 1.195 -1.813 0 N-CA-C 116.751 2.13 . . . . 66.62 116.751 172.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' B' ' 226' ' ' HOH . 3.3 mt-30 -45.63 -40.34 8.88 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 122.808 1.29 . . . . 92.81 113.173 175.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -56.67 -28.11 60.09 Favored 'General case' 0 CA--C 1.61 3.259 0 O-C-N 119.582 -1.948 . . . . 78.12 114.274 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -101.26 -0.59 35.49 Favored 'General case' 0 C--O 1.166 -3.333 0 CA-C-O 114.739 -2.553 . . . . 63.94 112.206 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 127.188 2.195 . . . . 60.19 113.56 -178.946 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 CA--C 1.557 1.239 0 CA-C-O 125.692 2.663 . . . . 77.48 110.128 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -56.35 151.58 43.86 Favored 'Trans proline' 0 C--O 1.17 -2.878 0 O-C-N 117.815 -1.729 . . . . 80.14 112.054 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' PRO . . . . . 0.507 ' O ' HD13 ' B' ' 109' ' ' ILE . 57.0 Cg_exo -55.17 141.96 79.09 Favored 'Trans proline' 0 C--O 1.17 -2.894 0 CA-C-O 113.871 -2.637 . . . . 75.25 110.472 163.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ILE . . . . . 1.411 ' CG1' ' CD1' ' B' ' 109' ' ' ILE . 27.0 mm -149.22 140.82 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 C-N-CA 127.584 2.354 . . . . 72.71 108.739 174.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' B' ' 232' ' ' HOH . . . -75.72 155.72 35.36 Favored 'General case' 0 C--O 1.177 -2.748 0 C-N-CA 118.581 -1.247 . . . . 73.55 110.131 177.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -51.09 -31.03 17.73 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.967 1.842 . . . . 77.91 113.371 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -99.96 -14.2 18.79 Favored 'General case' 1 C--O 1.114 -6.077 0 CA-C-N 113.386 -1.734 . . . . 92.03 109.575 -167.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -94.7 17.03 14.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 120.72 1.6 . . . . 75.63 107.254 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 15.1 mt -82.2 130.71 58.69 Favored Pre-proline 0 N--CA 1.494 1.741 0 C-N-CA 115.182 -2.607 . . . . 64.29 109.052 -172.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -85.13 130.54 4.07 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 124.62 3.547 . . . . 57.74 112.294 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 2.2 t80 68.86 59.1 0.37 Allowed 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 125.375 1.47 . . . . 59.41 109.164 168.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 47.4 t -79.1 101.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.683 0 CA-C-N 114.595 -1.184 . . . . 62.41 111.703 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 72.0 mt -70.48 -38.25 73.12 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.758 0 N-CA-C 113.336 0.865 . . . . 55.45 113.336 -178.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -156.09 150.12 25.31 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 129.277 3.031 . . . . 59.98 111.923 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -164.38 156.4 16.37 Favored 'General case' 1 C--O 1.127 -5.375 0 CA-C-N 114.259 -1.337 . . . . 56.54 109.398 -174.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.85 156.34 9.61 Favored Glycine 1 C--O 1.163 -4.333 0 N-CA-C 115.681 1.032 . . . . 56.54 115.681 -163.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . 0.251 39.4 m-85 -67.26 128.78 37.68 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 115.191 1.552 . . . . 68.26 115.191 160.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 17.1 mt -142.13 157.92 44.34 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.079 -1.452 . . . . 54.49 107.079 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLU . . . . . 0.493 ' HB2' ' HB ' ' B' ' 200' ' ' THR . 24.0 mt-10 -88.15 128.47 35.44 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.388 -1.278 . . . . 80.92 111.586 164.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -112.89 144.7 42.0 Favored 'General case' 0 C--O 1.176 -2.778 0 O-C-N 120.159 -1.588 . . . . 73.78 107.841 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . 0.371 56.6 ttp180 -146.42 151.29 37.2 Favored 'General case' 0 C--O 1.197 -1.686 0 C-N-CA 120.461 -0.496 . . . . 62.31 110.239 159.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -90.42 136.51 33.01 Favored 'General case' 0 C--O 1.252 1.205 0 O-C-N 121.072 -1.017 . . . . 56.72 109.818 169.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -60.36 -44.35 95.66 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 120.373 -0.531 . . . . 50.23 111.416 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -67.31 -21.35 65.68 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 114.859 1.429 . . . . 51.15 114.859 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -81.86 -39.09 24.44 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 114.734 -2.555 . . . . 58.85 112.394 169.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 97.7 p -54.78 -37.93 66.64 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 125.959 2.037 . . . . 58.44 115.39 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -50.18 -35.21 25.35 Favored 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 115.946 1.832 . . . . 48.3 115.946 169.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 87.4 mt -91.88 -1.32 57.38 Favored 'General case' 1 N--CA 1.376 -4.147 0 O-C-N 120.186 -1.571 . . . . 56.71 108.444 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.19 1.05 55.85 Favored Glycine 0 N--CA 1.411 -3.024 1 N-CA-C 124.256 4.462 . . . . 52.74 124.256 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -72.84 130.97 41.63 Favored 'General case' 0 C--O 1.178 -2.708 0 N-CA-C 103.482 -2.784 . . . . 57.86 103.482 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' B' ' 227' ' ' HOH . 2.2 tt0 -97.3 168.44 10.41 Favored 'General case' 0 C--N 1.272 -2.763 0 O-C-N 119.303 -2.123 . . . . 85.74 115.771 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -41.77 139.49 1.2 Allowed 'General case' 1 C--O 1.14 -4.678 0 C-N-CA 126.871 2.068 . . . . 56.37 115.91 169.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -135.05 136.35 42.0 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 119.838 -1.789 . . . . 70.99 109.804 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' LYS . . . . . 1.558 ' CE ' ' CD ' ' B' ' 139' ' ' LYS 0.309 16.3 mmtt -61.17 125.46 23.83 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 123.635 0.585 . . . . 79.95 109.707 173.756 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 87.3 mmt-85 -134.57 137.98 44.21 Favored 'General case' 0 CA--C 1.572 1.797 0 O-C-N 125.255 1.597 . . . . 56.46 110.81 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -78.95 117.29 19.89 Favored 'General case' 0 N--CA 1.411 -2.418 0 N-CA-C 105.854 -1.906 . . . . 62.98 105.854 164.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.08 142.87 46.44 Favored 'General case' 0 C--O 1.183 -2.441 0 O-C-N 125.793 1.933 . . . . 55.58 110.854 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.84 120.71 11.98 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.365 -2.198 . . . . 62.43 111.511 -169.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 47.0 tp -91.68 105.93 18.1 Favored 'General case' 0 C--N 1.273 -2.731 0 CA-C-O 123.798 1.761 . . . . 59.06 111.694 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.9 t -106.73 101.66 11.09 Favored 'General case' 1 C--O 1.151 -4.108 0 CA-C-N 112.273 -2.239 . . . . 55.96 106.926 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 146' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm 57.62 -123.16 1.56 Allowed 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 116.302 -1.809 . . . . 68.33 110.197 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' THR . . . . . 0.404 ' OG1' ' O ' ' B' ' 230' ' ' HOH . 1.2 p -95.91 15.07 21.44 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 126.029 1.731 . . . . 72.41 112.843 177.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' VAL . . . . . . . . . . . . . 53.7 t -115.45 129.85 71.04 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.199 0 CA-C-N 119.921 1.237 . . . . 57.5 109.129 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -96.49 117.53 31.09 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 114.756 -1.111 . . . . 53.49 109.353 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -111.52 148.93 32.14 Favored 'General case' 0 C--O 1.287 3.048 0 N-CA-C 108.518 -0.919 . . . . 59.8 108.518 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -139.96 140.25 36.29 Favored 'General case' 0 C--O 1.286 3.001 0 C-N-CA 117.998 -1.481 . . . . 51.15 110.927 173.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -132.31 156.97 45.61 Favored 'General case' 0 C--O 1.292 3.313 0 N-CA-C 103.584 -2.747 . . . . 63.26 103.584 -168.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.15 -44.11 97.69 Favored Glycine 0 C--N 1.354 1.544 0 CA-C-O 117.313 -1.826 . . . . 64.38 113.449 168.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 95.0 p -134.97 169.16 17.83 Favored 'General case' 2 N--CA 1.575 5.789 0 CA-C-N 120.06 1.93 . . . . 68.36 114.457 173.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 p30 -60.3 -21.74 62.34 Favored 'General case' 1 C--O 1.151 -4.127 0 N-CA-C 116.812 2.153 . . . . 73.89 116.812 171.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -93.7 -1.67 54.88 Favored 'General case' 0 C--O 1.181 -2.512 0 C-N-CA 127.215 2.206 . . . . 88.55 115.12 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -70.75 165.78 22.31 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 117.449 -3.282 . . . . 85.48 113.072 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -95.23 -10.8 29.34 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 127.344 3.45 . . . . 96.43 109.161 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -164.39 141.28 6.45 Favored 'General case' 0 C--N 1.283 -2.286 0 O-C-N 117.878 -3.014 . . . . 87.51 104.226 -165.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 16.7 pm0 -76.17 138.3 40.59 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.324 -2.216 . . . . 65.2 111.074 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -58.9 -28.93 66.64 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 123.449 1.595 . . . . 83.81 112.626 161.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . 172.0 -174.6 45.35 Favored Glycine 0 C--O 1.266 2.119 0 CA-C-O 123.607 1.67 . . . . 55.28 110.08 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.13 160.96 1.81 Allowed 'General case' 0 C--O 1.25 1.095 0 CA-C-N 112.372 -1.914 . . . . 60.2 113.745 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 164' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -151.81 141.31 21.63 Favored 'General case' 0 C--O 1.169 -3.173 0 CA-C-O 123.534 1.635 . . . . 51.96 108.729 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -80.61 133.13 35.71 Favored 'General case' 0 N--CA 1.414 -2.242 0 N-CA-C 106.885 -1.524 . . . . 52.59 106.885 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 pt -92.17 1.59 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 115.71 1.744 . . . . 56.41 115.71 -170.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -56.44 128.6 36.85 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 116.507 -2.077 . . . . 64.23 111.1 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . 77.67 15.56 81.17 Favored Glycine 0 C--O 1.191 -2.564 0 N-CA-C 116.179 1.232 . . . . 55.8 116.179 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' TYR . . . . . 0.436 ' HD2' HG22 ' B' ' 189' ' ' ILE . 3.3 m-85 -91.41 165.83 13.2 Favored 'General case' 1 C--O 1.148 -4.244 0 N-CA-C 102.113 -3.291 . . . . 58.78 102.113 -174.201 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -117.3 166.4 12.33 Favored 'General case' 0 C--O 1.168 -3.219 0 N-CA-C 114.475 1.287 . . . . 82.44 114.475 160.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 14.4 p -147.1 143.23 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.737 0 O-C-N 124.614 1.196 . . . . 60.08 109.31 -175.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -161.06 152.26 18.85 Favored 'General case' 0 N--CA 1.406 -2.635 0 N-CA-C 114.101 1.149 . . . . 71.66 114.101 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' MET . . . . . . . . . . . . . 86.6 mmm -74.27 147.32 42.47 Favored 'General case' 0 C--O 1.162 -3.54 0 N-CA-C 107.207 -1.405 . . . . 74.52 107.207 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -152.02 95.93 2.14 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 119.475 1.034 . . . . 67.75 109.432 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' ASN . . . . . 0.421 ' C ' ' OD1' ' B' ' 175' ' ' ASN . 39.9 p30 -88.16 11.84 15.26 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 117.658 -1.163 . . . . 86.7 108.114 -172.029 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 176' ' ' THR . . . . . . . . . . . . . 10.7 p -98.66 30.03 3.46 Favored 'General case' 0 C--O 1.165 -3.372 0 N-CA-C 116.204 1.927 . . . . 86.83 116.204 170.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 29.4 mt -119.39 -13.54 9.25 Favored 'General case' 0 C--O 1.201 -1.461 0 CA-C-N 124.669 3.395 . . . . 83.78 110.901 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 39.6 mtp85 -125.85 134.41 51.65 Favored 'General case' 1 C--O 1.321 4.839 0 N-CA-C 115.757 1.762 . . . . 94.32 115.757 172.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 179' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' B' ' 179' ' ' LYS . 13.3 tttt -84.51 77.97 9.92 Favored 'General case' 0 CA--C 1.588 2.415 0 N-CA-C 104.597 -2.372 . . . . 108.46 104.597 165.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 180' ' ' ASP . . . . . 0.552 ' HB3' ' H ' ' B' ' 182' ' ' LYS . 0.8 OUTLIER -152.77 178.27 9.82 Favored 'General case' 0 CA--C 1.444 -3.105 0 N-CA-C 103.357 -2.831 . . . . 106.81 103.357 -168.562 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.02 -4.34 84.5 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 108.171 -1.971 . . . . 104.27 108.171 165.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' LYS . . . . . 0.552 ' H ' ' HB3' ' B' ' 180' ' ' ASP . 3.5 mppt? -88.41 16.39 6.5 Favored 'General case' 0 C--O 1.2 -1.526 0 C-N-CA 125.789 1.636 . . . . 111.26 113.603 171.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 183' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -79.45 -31.18 42.45 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 119.143 3.016 . . . . 111.09 119.143 -168.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.37 -5.05 37.23 Favored 'General case' 0 C--O 1.304 3.933 0 C-N-CA 125.992 1.717 . . . . 108.21 114.018 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 185' ' ' CYS . . . . . 0.433 ' HB3' ' HA ' ' B' ' 204' ' ' PRO 0.268 1.7 p -116.62 42.59 2.41 Favored 'General case' 0 CA--C 1.571 1.76 1 N-CA-C 125.711 5.449 . . . . 83.12 125.711 174.218 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 186' ' ' CYS . . . . . . . . . . . . . 71.2 m -114.8 160.34 19.55 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.106 -1.861 . . . . 65.09 113.808 168.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -153.73 171.3 19.07 Favored 'General case' 0 C--O 1.197 -1.673 0 CA-C-O 116.894 -1.527 . . . . 53.96 110.133 170.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -132.09 151.51 51.73 Favored 'General case' 1 N--CA 1.367 -4.593 0 C-N-CA 124.278 1.031 . . . . 58.4 109.39 178.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 189' ' ' ILE . . . . . 0.436 HG22 ' HD2' ' B' ' 169' ' ' TYR . 73.4 mt -117.1 125.94 74.2 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.177 0 C-N-CA 126.461 1.904 . . . . 55.51 108.276 168.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 190' ' ' CYS . . . . . . . . . . . . . 74.1 m -115.85 117.27 29.73 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-O 122.259 1.028 . . . . 58.24 109.059 -167.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' ALA . . . . . . . . . . . . . . . -79.97 154.13 75.17 Favored Pre-proline 0 N--CA 1.403 -2.781 0 N-CA-C 117.285 2.328 . . . . 53.46 117.285 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -52.13 -40.95 67.62 Favored 'Trans proline' 0 C--O 1.181 -2.362 0 CA-C-O 112.302 -3.291 . . . . 61.34 115.986 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' B' ' 194' ' ' LYS . 0.9 OUTLIER -66.59 0.86 2.01 Favored 'General case' 0 CA--C 1.56 1.345 0 O-C-N 126.432 2.333 . . . . 86.12 114.43 170.873 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 194' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' B' ' 193' ' ' ASP . 0.8 OUTLIER 86.27 3.81 0.49 Allowed 'General case' 0 C--O 1.16 -3.649 0 CA-C-O 124.068 1.89 . . . . 77.4 115.648 172.337 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 195' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.08 136.92 53.03 Favored 'General case' 0 C--O 1.167 -3.276 0 O-C-N 119.837 -1.789 . . . . 59.31 113.809 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' ILE . . . . . . . . . . . . . 96.1 mt -131.17 127.45 60.64 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-O 123.698 1.713 . . . . 47.68 110.645 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -107.32 119.43 39.38 Favored 'General case' 0 C--N 1.263 -3.172 0 CA-C-O 125.849 2.738 . . . . 59.39 105.57 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -108.68 141.42 40.67 Favored 'General case' 0 C--N 1.268 -2.962 0 O-C-N 119.989 -1.695 . . . . 46.6 106.879 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 124' ' ' GLU . 95.7 m-85 -131.57 147.75 52.56 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 123.489 1.614 . . . . 54.43 109.357 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 200' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' B' ' 124' ' ' GLU . 76.9 m -112.21 130.21 56.0 Favored 'General case' 0 C--O 1.196 -1.715 0 CA-C-N 113.963 -1.472 . . . . 60.29 109.498 163.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ALA . . . . . . . . . . . . . . . -100.65 173.29 6.61 Favored 'General case' 1 C--O 1.117 -5.875 0 O-C-N 121.449 -0.782 . . . . 68.44 110.87 177.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 202' ' ' ALA . . . . . . . . . . . . . . . -78.54 -10.96 59.92 Favored 'General case' 0 C--O 1.169 -3.159 0 C-N-CA 126.026 1.73 . . . . 73.72 112.322 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 61.4 p -165.0 166.1 11.28 Favored Pre-proline 0 N--CA 1.506 2.334 0 CA-C-N 122.129 2.241 . . . . 72.46 105.567 169.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' PRO . . . . . 0.433 ' HA ' ' HB3' ' B' ' 185' ' ' CYS . 37.4 Cg_exo -61.24 -29.33 86.29 Favored 'Trans proline' 0 CA--C 1.561 1.826 0 CA-C-O 126.475 2.614 . . . . 73.11 114.89 -178.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 205' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -69.66 -42.53 74.07 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 111.903 -2.408 . . . . 98.82 104.988 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -64.61 -43.52 93.49 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 125.413 1.485 . . . . 83.95 109.757 -174.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -55.22 -55.68 28.5 Favored 'General case' 0 N--CA 1.4 -2.95 0 N-CA-C 113.586 0.958 . . . . 64.71 113.586 172.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.14 -34.06 69.86 Favored 'General case' 0 CA--C 1.486 -1.487 0 C-N-CA 123.689 0.795 . . . . 98.21 111.117 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 209' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -64.76 -44.64 89.41 Favored 'General case' 0 C--O 1.165 -3.371 0 N-CA-C 114.297 1.221 . . . . 85.31 114.297 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 210' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -60.19 -43.58 95.79 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 113.202 0.816 . . . . 58.15 113.202 173.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.31 -50.09 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 CA-C-O 117.516 -1.231 . . . . 53.41 113.835 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 212' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -54.49 -51.46 65.0 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 124.849 1.343 . . . . 94.75 110.038 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 213' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -60.45 -42.19 95.63 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 113.98 -1.464 . . . . 57.7 110.743 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.49 -42.43 68.07 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 117.224 -1.791 . . . . 59.97 107.928 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -60.93 -39.68 90.34 Favored 'General case' 0 C--O 1.282 2.795 0 CA-C-O 117.371 -1.299 . . . . 79.22 109.306 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 216' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -55.48 -50.48 69.79 Favored 'General case' 0 C--O 1.178 -2.686 0 O-C-N 127.103 2.752 . . . . 79.05 116.48 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 217' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.74 -42.89 93.44 Favored 'Isoleucine or valine' 1 C--O 1.127 -5.387 0 O-C-N 119.601 -1.937 . . . . 65.25 111.709 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.57 -0.09 7.87 Favored 'General case' 0 C--O 1.195 -1.811 0 CA-C-N 120.588 1.54 . . . . 79.21 109.852 -174.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 219' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -134.03 -49.56 0.81 Allowed 'General case' 1 CA--C 1.414 -4.259 0 CA-C-O 117.46 -1.257 . . . . 92.27 113.954 -172.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 220' ' ' ASP . . . . . 1.146 ' HB2' ' O ' ' B' ' 231' ' ' HOH 0.279 0.6 OUTLIER -116.85 72.16 0.82 Allowed 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 112.146 -3.822 . . . . 115.37 115.943 177.37 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . 0.286 0.0 OUTLIER -126.26 -56.8 1.42 Allowed 'General case' 0 N--CA 1.4 -2.97 3 CA-C-N 105.364 -5.38 . . . . 96.38 101.164 159.792 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.746 0 CA-C-N 114.693 -1.14 . . . . 95.09 111.581 171.062 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . 0.738 ' O ' HG22 ' A' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . 1.093 ' O ' ' HG2' ' A' ' 136' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . 0.45 ' O ' ' HG3' ' A' ' 61' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . 0.656 ' O ' ' C ' ' A' ' 64' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . 0.495 ' O ' ' HD3' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 226' ' ' HOH . . . . . 0.588 ' O ' ' HB2' ' B' ' 61' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 227' ' ' HOH . . . . . 0.456 ' O ' ' HA ' ' B' ' 136' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HOH . . . . . 0.404 ' O ' ' OG1' ' B' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 231' ' ' HOH . . . . . 1.146 ' O ' ' HB2' ' B' ' 220' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 232' ' ' HOH . . . . . 0.409 ' O ' ' HB1' ' B' ' 110' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . . . . . . 2 CA--C 1.593 4.942 0 CA-C-O 114.688 -3.284 . . . . 100.84 116.473 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . 0.421 ' HA ' ' HD3' ' A' ' 14' ' ' PRO 0.449 0.4 OUTLIER -110.41 89.51 8.83 Favored Pre-proline 2 N--CA 1.603 7.222 0 C-N-CA 130.4 3.48 . . . . 98.3 120.042 146.979 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 13' ' ' SER . 46.8 Cg_exo -53.75 -54.81 4.23 Favored 'Trans proline' 0 N--CA 1.43 -2.224 1 N-CA-C 124.973 4.951 . . . . 85.15 124.973 -133.948 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -50.75 -44.32 58.42 Favored 'General case' 1 CA--C 1.415 -4.213 0 CA-C-N 122.511 2.414 . . . . 80.09 114.969 -172.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.303 2.7 pt-20 -73.07 -21.62 60.74 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 119.69 3.218 . . . . 74.61 119.69 -174.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.624 ' CG1' ' CD1' ' A' ' 17' ' ' ILE . 29.2 mm -79.01 -47.49 22.7 Favored 'Isoleucine or valine' 1 N--CA 1.35 -5.457 0 O-C-N 126.124 2.14 . . . . 51.3 107.596 177.139 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . 0.25 85.3 mtm-85 -60.24 -29.23 68.62 Favored 'General case' 0 C--O 1.278 2.563 0 C-N-CA 115.75 -2.38 . . . . 52.36 115.876 172.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.485 ' ND2' ' O ' ' A' ' 194' ' ' LYS . 98.0 m-20 -60.1 -42.51 94.84 Favored 'General case' 0 N--CA 1.524 3.249 0 CA-C-N 115.863 -0.608 . . . . 54.47 111.776 171.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.52 -45.62 78.91 Favored 'General case' 0 C--O 1.17 -3.079 0 N-CA-C 115.86 1.8 . . . . 47.82 115.86 175.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.74 -34.63 77.22 Favored 'General case' 0 N--CA 1.395 -3.19 0 C-N-CA 118.713 -1.195 . . . . 50.08 110.417 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -54.74 -46.53 74.31 Favored 'General case' 0 CA--C 1.586 2.343 0 N-CA-C 114.937 1.458 . . . . 48.8 114.937 170.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -63.78 -39.97 95.54 Favored 'General case' 0 C--O 1.287 3.07 0 C-N-CA 123.925 0.89 . . . . 63.26 112.986 172.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.4 t -58.52 -54.63 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-N 115.868 -0.605 . . . . 47.28 112.003 172.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.94 -41.17 70.71 Favored 'General case' 0 C--O 1.168 -3.236 0 N-CA-C 118.096 2.628 . . . . 58.53 118.096 173.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.2 m -58.72 -53.25 60.52 Favored 'General case' 0 C--O 1.167 -3.276 0 C-N-CA 125.688 1.595 . . . . 54.5 108.457 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -51.48 -65.51 0.54 Allowed 'General case' 0 N--CA 1.395 -3.224 0 N-CA-C 120.269 3.433 . . . . 54.04 120.269 171.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.478 ' HA ' HD12 ' A' ' 32' ' ' LEU . 20.4 t -62.1 -46.36 96.65 Favored 'Isoleucine or valine' 0 CA--C 1.427 -3.786 0 O-C-N 119.88 -1.762 . . . . 51.04 112.87 178.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.21 -43.73 50.26 Favored 'General case' 0 CA--C 1.619 3.633 0 C-N-CA 116.489 -2.084 . . . . 55.96 114.856 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 56.1 m-20 -103.74 -54.64 2.53 Favored 'General case' 0 C--O 1.289 3.145 0 C-N-CA 117.104 -1.838 . . . . 70.56 115.184 -172.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 57.1 m -48.88 -43.1 38.73 Favored 'General case' 0 N--CA 1.394 -3.263 0 C-N-CA 118.631 -1.228 . . . . 55.77 113.021 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' A' ' 28' ' ' VAL . 48.1 mt -82.75 -8.76 59.57 Favored 'General case' 0 C--O 1.179 -2.65 0 CA-C-O 117.646 -1.169 . . . . 52.26 111.008 -174.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 tttm -69.62 135.83 50.44 Favored 'General case' 0 C--O 1.303 3.906 0 O-C-N 125.467 1.729 . . . . 78.84 108.299 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.88 -17.29 16.93 Favored Glycine 0 N--CA 1.478 1.451 0 CA-C-N 115.259 -0.882 . . . . 62.55 113.888 -171.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' OE2' ' OG ' ' B' ' 38' ' ' SER . 49.6 mm-40 -70.44 161.27 30.84 Favored 'General case' 0 C--O 1.164 -3.433 0 O-C-N 119.235 -2.332 . . . . 67.48 113.157 -174.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -96.52 92.82 6.45 Favored 'General case' 0 C--N 1.282 -2.341 0 O-C-N 118.224 -2.798 . . . . 71.13 108.056 -169.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.8 mt -111.04 154.51 24.1 Favored 'General case' 0 C--O 1.264 1.856 0 C-N-CA 118.736 -1.185 . . . . 68.39 110.563 -166.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . 0.589 ' OG ' ' OE2' ' B' ' 35' ' ' GLU . 0.0 OUTLIER -55.99 170.07 0.33 Allowed 'General case' 0 CA--C 1.485 -1.525 0 N-CA-C 107.316 -1.364 . . . . 71.56 107.316 171.964 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.4 tttp -75.22 -29.92 60.42 Favored 'General case' 0 CA--C 1.593 2.629 0 N-CA-C 109.07 -0.715 . . . . 90.41 109.07 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.495 ' HD3' ' O ' ' A' ' 232' ' ' HOH . 14.5 tttm -73.46 -57.55 3.93 Favored 'General case' 1 N--CA 1.377 -4.087 0 N-CA-C 102.226 -3.25 . . . . 88.15 102.226 -173.761 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -51.55 -31.81 25.74 Favored 'General case' 0 CA--C 1.582 2.211 0 CA-C-O 117.935 -1.031 . . . . 67.46 113.685 174.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 34.0 mttt -70.75 -37.05 73.4 Favored 'General case' 0 C--O 1.156 -3.855 0 CA-C-N 120.071 1.305 . . . . 82.16 108.942 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -78.29 -37.78 44.07 Favored 'General case' 0 N--CA 1.396 -3.154 0 N-CA-C 105.097 -2.186 . . . . 86.78 105.097 -167.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -69.73 -33.51 72.57 Favored 'General case' 0 C--O 1.182 -2.473 0 N-CA-C 117.769 2.507 . . . . 73.22 117.769 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.7 ttt-85 -63.72 -30.33 71.44 Favored 'General case' 1 N--CA 1.366 -4.634 0 CA-C-N 115.425 -0.807 . . . . 59.38 110.972 173.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 42' ' ' LYS . 2.1 mm-40 -81.77 -43.91 17.72 Favored 'General case' 0 C--O 1.178 -2.679 0 N-CA-C 102.835 -3.024 . . . . 92.91 102.835 -168.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -46.5 -55.35 7.65 Favored 'General case' 0 N--CA 1.396 -3.174 0 N-CA-C 118.356 2.725 . . . . 58.91 118.356 166.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.4 mt -62.34 -37.15 84.53 Favored 'General case' 1 N--CA 1.365 -4.681 0 CA-C-O 116.272 -1.823 . . . . 61.13 108.208 -174.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.6 -42.87 89.66 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.713 0 O-C-N 124.713 1.258 . . . . 48.72 111.344 -178.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -63.56 -47.33 81.97 Favored 'General case' 0 N--CA 1.485 1.309 0 O-C-N 124.875 1.359 . . . . 77.51 108.66 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.446 ' NZ ' ' OD2' ' B' ' 23' ' ' ASP . 85.2 mttt -59.81 -38.19 81.27 Favored 'General case' 0 C--O 1.17 -3.124 0 N-CA-C 115.228 1.566 . . . . 53.89 115.228 177.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 96.8 mt -59.6 -43.2 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.414 0 CA-C-O 122.678 1.228 . . . . 50.59 113.276 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . 0.318 69.2 mttt -57.78 -44.1 85.98 Favored 'General case' 0 C--O 1.259 1.586 0 CA-C-N 111.674 -2.512 . . . . 73.69 115.974 175.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -78.71 -25.61 44.69 Favored 'General case' 1 C--O 1.139 -4.719 0 N-CA-C 106.641 -1.614 . . . . 77.69 106.641 -170.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.515 ' O ' ' HB ' ' A' ' 58' ' ' VAL . 0.3 OUTLIER -73.81 -14.55 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.453 0 CA-C-N 122.493 2.406 . . . . 50.4 110.554 -171.239 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 60.6 mttt -64.2 -26.2 68.41 Favored 'General case' 0 C--O 1.192 -1.937 0 C-N-CA 126.139 1.775 . . . . 51.51 112.312 -172.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 70.4 p -72.95 -8.64 56.57 Favored 'General case' 0 CA--C 1.427 -3.773 0 CA-C-O 124.41 2.052 . . . . 53.98 114.099 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 55' ' ' VAL . 0.5 OUTLIER -77.54 -24.84 14.68 Favored 'Isoleucine or valine' 0 C--O 1.159 -3.698 0 CA-C-N 113.205 -1.816 . . . . 55.87 110.336 -174.257 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -94.14 8.03 43.1 Favored 'General case' 1 N--CA 1.365 -4.677 0 O-C-N 120.156 -1.59 . . . . 51.55 108.018 -173.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.61 -55.14 17.7 Favored 'General case' 0 CA--C 1.472 -2.055 0 N-CA-C 119.053 2.983 . . . . 60.69 119.053 171.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 230' ' ' HOH . 64.7 mt-30 -52.13 -26.85 12.25 Favored 'General case' 0 C--O 1.191 -1.988 0 C-N-CA 126.096 1.758 . . . . 96.23 111.747 178.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -66.1 -30.94 71.53 Favored 'General case' 0 CA--C 1.448 -2.97 0 O-C-N 121.484 -0.76 . . . . 72.95 112.134 176.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -99.14 0.42 43.42 Favored 'General case' 1 C--O 1.132 -5.121 0 CA-C-O 115.344 -2.265 . . . . 57.86 112.393 -174.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.656 ' C ' ' O ' ' A' ' 231' ' ' HOH . 91.4 mt-30 . . . . . 0 N--CA 1.501 2.112 0 C-N-CA 130.453 3.501 . . . . 60.71 116.753 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 . . . . . 0 CA--C 1.477 -1.842 0 N-CA-C 114.157 1.169 . . . . 76.98 114.157 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -71.62 150.89 57.69 Favored 'Trans proline' 0 C--O 1.166 -3.098 0 N-CA-C 118.873 2.605 . . . . 74.95 118.873 -178.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PRO . . . . . 0.41 ' HB3' HE21 ' A' ' 159' ' ' GLN . 37.7 Cg_exo -60.23 149.53 84.85 Favored 'Trans proline' 0 C--O 1.197 -1.542 0 CA-C-N 121.715 1.648 . . . . 70.63 112.679 175.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 18.1 tt -159.64 138.55 3.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.597 0 C-N-CA 125.58 1.552 . . . . 63.59 109.815 -175.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.88 153.58 39.79 Favored 'General case' 0 C--O 1.17 -3.124 0 O-C-N 120.553 -1.342 . . . . 64.22 111.685 -175.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -48.1 -49.03 33.27 Favored 'General case' 0 C--O 1.178 -2.7 0 O-C-N 119.995 -1.691 . . . . 60.54 114.421 174.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -80.48 -3.39 49.8 Favored 'General case' 0 C--O 1.17 -3.126 0 C-N-CA 125.883 1.673 . . . . 85.08 113.241 -171.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -106.48 1.89 25.87 Favored 'General case' 0 N--CA 1.407 -2.599 0 CA-C-N 119.928 1.24 . . . . 72.08 113.835 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 14.1 mt -60.48 124.42 78.37 Favored Pre-proline 0 CA--C 1.485 -1.543 0 CA-C-N 120.167 1.348 . . . . 63.97 109.392 178.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -76.4 160.85 35.25 Favored 'Trans proline' 1 CA--C 1.63 5.29 0 O-C-N 123.06 1.032 . . . . 50.67 114.021 174.258 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 5.5 t80 39.05 58.83 1.76 Allowed 'General case' 0 C--O 1.283 2.827 0 C-N-CA 126.079 1.752 . . . . 49.71 110.33 170.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 84.2 t -79.07 98.45 2.83 Favored 'Isoleucine or valine' 1 C--O 1.143 -4.52 0 CA-C-N 114.687 -1.142 . . . . 47.35 109.116 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 94.0 mt -69.51 -32.97 54.93 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.717 0 CA-C-O 116.605 -1.664 . . . . 50.13 115.152 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 55.9 tttp -159.33 142.76 14.61 Favored 'General case' 1 N--CA 1.358 -5.075 0 CA-C-O 123.937 1.827 . . . . 49.03 111.212 173.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -145.1 161.21 40.02 Favored 'General case' 1 C--O 1.124 -5.514 0 C-N-CA 116.798 -1.961 . . . . 51.38 105.847 179.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.96 165.89 25.13 Favored Glycine 0 N--CA 1.405 -3.367 0 CA-C-O 118.169 -1.351 . . . . 50.64 111.59 176.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 48.2 m-85 -79.08 131.2 36.18 Favored 'General case' 0 C--O 1.186 -2.268 0 CA-C-O 122.105 0.955 . . . . 53.93 112.57 171.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 33.7 mt -135.52 158.3 44.72 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.785 -0.821 . . . . 50.19 108.785 175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -89.14 147.44 24.2 Favored 'General case' 0 N--CA 1.534 3.747 0 C-N-CA 114.61 -2.836 . . . . 78.23 110.379 163.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.3 ttpp -137.48 151.38 48.41 Favored 'General case' 0 N--CA 1.426 -1.665 0 N-CA-C 103.659 -2.719 . . . . 75.34 103.659 -166.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.42 ' CZ ' ' OG ' ' A' ' 131' ' ' SER . 46.4 ttp180 -169.13 130.16 1.14 Allowed 'General case' 0 N--CA 1.424 -1.756 0 N-CA-C 105.821 -1.918 . . . . 68.7 105.821 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 57.7 mtp180 -73.5 142.02 46.78 Favored 'General case' 0 CA--C 1.615 3.474 0 CA-C-O 122.048 0.928 . . . . 64.35 112.226 168.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -58.16 -37.83 75.44 Favored 'General case' 1 CA--C 1.419 -4.082 0 CA-C-N 114.17 -1.377 . . . . 60.49 112.828 -179.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.83 -11.51 59.58 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.076 -1.049 . . . . 56.28 110.57 -174.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HIS . . . . . . . . . . . . . 65.4 m170 -85.38 -33.94 21.88 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 124.066 1.889 . . . . 50.77 114.646 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' SER . . . . . 0.42 ' OG ' ' CZ ' ' A' ' 126' ' ' ARG . 0.6 OUTLIER -57.05 -47.64 80.46 Favored 'General case' 0 C--N 1.27 -2.875 0 C-N-CA 126.417 1.887 . . . . 56.27 115.109 174.811 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -49.39 -34.28 15.86 Favored 'General case' 0 N--CA 1.384 -3.747 0 N-CA-C 114.596 1.332 . . . . 46.09 114.596 169.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 94.1 mt -89.58 0.13 57.13 Favored 'General case' 0 N--CA 1.51 2.556 0 CA-C-N 115.789 -0.642 . . . . 48.64 111.401 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.2 14.33 64.42 Favored Glycine 0 N--CA 1.417 -2.627 0 N-CA-C 120.118 2.807 . . . . 50.97 120.118 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -69.47 140.29 54.0 Favored 'General case' 0 C--O 1.165 -3.343 0 CA-C-N 118.205 1.003 . . . . 63.6 111.252 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . 1.524 ' CG ' ' CD ' ' A' ' 136' ' ' GLU 0.255 1.1 tt0 -68.44 146.28 53.33 Favored 'General case' 0 N--CA 1.395 -3.203 0 CA-C-O 123.681 1.705 . . . . 96.46 112.346 -179.436 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -52.24 146.14 9.69 Favored 'General case' 0 N--CA 1.401 -2.92 0 O-C-N 119.413 -2.054 . . . . 68.33 111.343 162.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -118.8 130.13 55.62 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 129.524 3.13 . . . . 81.32 107.544 178.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LYS . . . . . 1.603 ' CD ' ' CE ' ' A' ' 139' ' ' LYS . 0.4 OUTLIER -67.52 128.01 34.85 Favored 'General case' 0 CA--C 1.59 2.5 0 N-CA-C 104.36 -2.459 . . . . 82.17 104.36 174.164 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 70.8 mmt-85 -139.06 148.59 43.55 Favored 'General case' 0 C--O 1.249 1.045 0 C-N-CA 117.72 -1.592 . . . . 51.87 107.952 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 34.0 t90 -90.58 118.67 30.21 Favored 'General case' 0 C--O 1.28 2.688 0 N-CA-C 102.824 -3.028 . . . . 63.24 102.824 168.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' CYS . . . . . . . . . . . . . 72.6 m -108.2 140.58 41.22 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.145 -0.934 . . . . 49.66 110.103 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -139.41 133.77 31.48 Favored 'General case' 0 CA--C 1.425 -3.838 0 CA-C-N 114.066 -1.425 . . . . 46.02 113.585 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 50.9 tp -101.99 100.32 10.59 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 125.026 1.454 . . . . 46.57 110.737 173.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . 0.25 23.2 t -107.44 109.92 21.75 Favored 'General case' 0 C--O 1.268 2.029 0 N-CA-C 106.111 -1.811 . . . . 53.16 106.111 -170.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' LYS . . . . . . . . . . . . . 27.3 mttt 53.96 -124.52 2.23 Favored 'General case' 1 C--O 1.148 -4.278 0 C-N-CA 116.057 -2.257 . . . . 75.22 112.178 -165.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' THR . . . . . 0.738 HG22 ' O ' ' A' ' 226' ' ' HOH . 1.9 m -97.24 18.37 15.2 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 127.646 2.378 . . . . 61.45 108.659 -178.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 76.4 t -130.72 132.83 64.01 Favored 'Isoleucine or valine' 0 C--O 1.288 3.13 1 O-C-N 116.281 -4.012 . . . . 52.05 108.366 -174.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 38.6 t80 -95.39 122.12 37.78 Favored 'General case' 1 N--CA 1.376 -4.157 0 O-C-N 127.787 3.179 . . . . 47.23 110.63 -174.13 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -116.6 150.5 37.95 Favored 'General case' 0 CA--C 1.491 -1.307 0 O-C-N 118.94 -2.35 . . . . 51.68 112.973 -176.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 3.5 p90 -135.48 136.81 41.57 Favored 'General case' 0 C--O 1.179 -2.644 0 C-N-CA 117.664 -1.614 . . . . 50.66 111.093 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -130.28 159.51 36.7 Favored 'General case' 0 C--O 1.287 3.043 0 O-C-N 126.295 2.247 . . . . 59.08 112.235 -178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -50.46 -49.14 40.09 Favored Glycine 0 C--O 1.195 -2.334 0 N-CA-C 115.939 1.135 . . . . 55.85 115.939 163.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 60.7 p -152.37 177.48 10.54 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 103.918 -2.623 . . . . 62.24 103.918 172.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 54.1 p-10 -69.84 0.48 5.69 Favored 'General case' 1 C--O 1.312 4.356 0 N-CA-C 117.51 2.411 . . . . 70.02 117.51 177.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -113.3 4.27 16.34 Favored 'General case' 0 C--O 1.18 -2.603 0 CA-C-O 115.248 -2.311 . . . . 89.01 110.685 -176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.22 161.0 31.06 Favored 'General case' 0 CA--C 1.463 -2.377 0 N-CA-C 106.08 -1.822 . . . . 70.99 106.08 -171.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -101.68 -4.62 26.2 Favored 'General case' 1 C--O 1.137 -4.839 0 CA-C-O 125.696 2.665 . . . . 94.76 106.663 -173.537 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLN . . . . . 0.41 HE21 ' HB3' ' A' ' 108' ' ' PRO . 20.4 tt0 -158.09 148.04 20.07 Favored 'General case' 0 C--N 1.26 -3.316 1 O-C-N 116.027 -4.171 . . . . 90.03 105.895 -174.47 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 19.4 pm0 -81.72 152.64 26.95 Favored 'General case' 0 C--O 1.265 1.893 0 C-N-CA 124.101 0.961 . . . . 64.89 112.773 -175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 15.5 mmtm -78.81 -17.33 55.88 Favored 'General case' 0 C--O 1.177 -2.737 0 N-CA-C 108.65 -0.87 . . . . 78.27 108.65 173.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLY . . . . . . . . . . . . . . . 166.19 160.68 13.79 Favored Glycine 0 C--O 1.29 3.602 1 N-CA-C 101.042 -4.823 . . . . 57.41 101.042 -165.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.81 169.37 24.51 Favored 'General case' 1 C--O 1.092 -7.187 0 CA-C-O 123.638 1.685 . . . . 62.77 112.126 169.338 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' PHE . . . . . . . . . . . . . 27.4 p90 -157.68 142.58 16.67 Favored 'General case' 0 C--N 1.267 -2.998 0 O-C-N 117.44 -3.287 . . . . 53.39 109.679 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -75.43 129.7 37.74 Favored 'General case' 0 C--O 1.18 -2.559 0 C-N-CA 126.108 1.763 . . . . 51.45 108.629 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ILE . . . . . 0.402 ' O ' ' C ' ' A' ' 167' ' ' ASP . 28.1 pt -84.72 -10.06 11.49 Favored 'Isoleucine or valine' 1 C--O 1.125 -5.459 0 N-CA-C 116.105 1.891 . . . . 54.31 116.105 -173.692 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASP . . . . . 0.402 ' C ' ' O ' ' A' ' 166' ' ' ILE . 15.3 t70 -42.12 122.71 2.21 Favored 'General case' 0 CA--C 1.472 -2.045 0 CA-C-N 120.018 1.281 . . . . 61.92 112.714 172.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLY . . . . . . . . . . . . . . . 91.68 -3.95 78.75 Favored Glycine 0 C--O 1.252 1.255 0 C-N-CA 117.602 -2.237 . . . . 59.25 115.879 173.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' TYR . . . . . 0.412 ' CE2' ' HB2' ' A' ' 191' ' ' ALA . 9.8 m-85 -87.35 161.14 18.08 Favored 'General case' 0 N--CA 1.412 -2.332 0 N-CA-C 105.518 -2.031 . . . . 79.1 105.518 -176.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -114.36 157.84 22.28 Favored 'General case' 0 N--CA 1.393 -3.294 0 O-C-N 120.06 -1.65 . . . . 81.84 110.717 164.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 5.9 p -135.41 145.8 31.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.917 0 CA-C-O 121.527 0.679 . . . . 55.06 111.267 174.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -158.07 156.36 30.89 Favored 'General case' 0 C--O 1.165 -3.383 0 N-CA-C 118.801 2.889 . . . . 73.93 118.801 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' MET . . . . . . . . . . . . . 78.5 mmm -65.34 145.29 56.38 Favored 'General case' 0 CA--C 1.471 -2.09 0 N-CA-C 107.599 -1.26 . . . . 58.27 107.599 167.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -153.37 103.07 2.64 Favored 'General case' 0 N--CA 1.417 -2.101 0 N-CA-C 107.884 -1.154 . . . . 58.24 107.884 175.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ASN . . . . . . . . . . . . . 25.6 p30 -79.9 -5.92 56.47 Favored 'General case' 1 C--O 1.142 -4.572 0 CA-C-N 114.217 -1.356 . . . . 79.69 114.007 -173.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 7.7 p -88.2 21.69 2.71 Favored 'General case' 1 C--O 1.152 -4.071 0 O-C-N 119.485 -2.009 . . . . 68.15 115.643 176.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 68.0 mt -103.82 -4.79 23.11 Favored 'General case' 0 CA--C 1.48 -1.732 0 O-C-N 117.116 -3.49 . . . . 71.19 106.062 -167.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ARG . . . . . . . . . . . . 0.269 1.6 mtp85 -143.92 148.9 36.04 Favored 'General case' 0 N--CA 1.4 -2.967 0 CA-C-O 118.522 -0.752 . . . . 77.77 110.09 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.44 -21.28 21.98 Favored 'General case' 0 C--N 1.369 1.433 0 N-CA-C 115.535 1.68 . . . . 98.55 115.535 179.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -78.77 -166.06 0.83 Allowed 'General case' 0 C--O 1.276 2.468 0 N-CA-C 120.211 3.411 . . . . 87.85 120.211 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.97 -5.13 86.7 Favored Glycine 0 CA--C 1.562 2.991 0 O-C-N 121.406 -0.809 . . . . 87.92 114.718 -178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -94.07 14.19 20.66 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 113.328 0.862 . . . . 89.37 113.328 176.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.44 -23.95 61.15 Favored 'General case' 0 C--O 1.275 2.433 0 N-CA-C 115.625 1.713 . . . . 95.6 115.625 -170.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . 0.293 1.2 m-20 -67.92 -13.37 62.11 Favored 'General case' 0 C--O 1.188 -2.184 0 C-N-CA 126.686 1.994 . . . . 103.36 114.819 174.388 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' CYS . . . . . . . . . . . . . 78.3 m -90.99 21.03 4.42 Favored 'General case' 0 CA--C 1.462 -2.425 0 N-CA-C 118.585 2.809 . . . . 66.57 118.585 175.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' CYS . . . . . . . . . . . . . 92.5 m -120.76 141.19 50.71 Favored 'General case' 0 N--CA 1.386 -3.648 0 N-CA-C 114.98 1.474 . . . . 57.56 114.98 -166.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -148.87 158.58 44.27 Favored 'General case' 0 N--CA 1.424 -1.736 0 C-N-CA 128.543 2.737 . . . . 49.96 109.49 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -132.84 148.47 52.31 Favored 'General case' 1 N--CA 1.379 -4.006 0 CA-C-N 111.961 -2.381 . . . . 58.49 112.505 -179.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.6 HD12 ' CE1' ' A' ' 199' ' ' PHE . 79.7 mt -119.87 104.08 15.11 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.662 0 CA-C-N 111.367 -2.652 . . . . 52.69 105.934 -178.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' CYS . . . . . . . . . . . . . 37.4 m -81.45 107.34 14.14 Favored 'General case' 1 CA--C 1.632 4.125 0 CA-C-N 112.338 -2.21 . . . . 78.5 115.123 176.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' ALA . . . . . 0.412 ' HB2' ' CE2' ' A' ' 169' ' ' TYR 0.349 . . -52.33 152.04 6.61 Favored Pre-proline 0 CA--C 1.619 3.607 0 N-CA-C 120.045 3.35 . . . . 83.55 120.045 154.437 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -68.45 -48.09 1.27 Allowed 'Trans proline' 1 N--CA 1.565 5.697 0 C-N-CA 123.003 2.469 . . . . 90.93 117.535 168.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -51.64 26.13 0.0 OUTLIER 'General case' 1 C--O 1.307 4.088 0 C-N-CA 129.757 3.223 . . . . 105.32 116.161 159.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' LYS . . . . . 1.594 ' CG ' ' CD ' ' A' ' 194' ' ' LYS 0.446 0.0 OUTLIER 34.86 48.35 0.32 Allowed 'General case' 1 CA--C 1.711 7.159 0 N-CA-C 121.741 3.978 . . . . 97.08 121.741 -166.118 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.93 127.83 51.45 Favored 'General case' 1 C--O 1.118 -5.852 0 O-C-N 117.735 -3.103 . . . . 87.4 111.365 174.657 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ILE . . . . . . . . . . . . . 95.8 mt -125.15 129.37 73.24 Favored 'Isoleucine or valine' 0 C--O 1.16 -3.644 0 CA-C-N 124.086 3.13 . . . . 56.76 111.219 -172.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -104.71 126.94 52.29 Favored 'General case' 0 C--O 1.173 -2.935 0 N-CA-C 108.934 -0.765 . . . . 69.05 108.934 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -106.83 132.0 53.29 Favored 'General case' 0 C--O 1.185 -2.325 0 C-N-CA 124.321 1.048 . . . . 50.57 111.008 175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' PHE . . . . . 0.6 ' CE1' HD12 ' A' ' 189' ' ' ILE . 18.9 m-85 -119.76 148.52 43.31 Favored 'General case' 0 C--O 1.302 3.86 0 N-CA-C 120.269 3.433 . . . . 46.12 120.269 168.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' THR . . . . . . . . . . . . . 9.5 m -114.29 127.96 56.13 Favored 'General case' 0 C--O 1.195 -1.779 0 CA-C-O 123.841 1.781 . . . . 52.99 112.752 160.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ALA . . . . . . . . . . . . . . . -99.15 175.3 5.94 Favored 'General case' 2 C--O 1.094 -7.112 0 N-CA-C 103.924 -2.621 . . . . 56.12 103.924 -171.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -85.71 -9.44 57.17 Favored 'General case' 0 C--O 1.157 -3.788 0 O-C-N 119.865 -1.772 . . . . 62.72 109.442 -170.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 6.3 p -163.89 162.85 16.28 Favored Pre-proline 0 N--CA 1.398 -3.026 0 O-C-N 119.205 -2.184 . . . . 61.88 110.248 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' PRO . . . . . 0.722 ' O ' ' HG3' ' A' ' 208' ' ' GLU . 66.3 Cg_exo -56.39 -23.99 49.76 Favored 'Trans proline' 0 C--N 1.297 -2.158 0 C-N-CA 117.181 -1.413 . . . . 59.72 114.127 177.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' LYS . . . . . . . . . . . . . 28.9 tptt -84.0 -38.99 20.23 Favored 'General case' 1 C--O 1.133 -5.07 0 N-CA-C 108.234 -1.025 . . . . 69.16 108.234 -173.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -57.62 -40.55 79.41 Favored 'General case' 0 C--O 1.175 -2.838 0 CA-C-N 114.455 -1.248 . . . . 60.22 110.258 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ALA . . . . . . . . . . . . . . . -69.25 -50.46 46.84 Favored 'General case' 0 N--CA 1.407 -2.577 0 C-N-CA 119.331 -0.947 . . . . 53.36 112.403 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' GLU . . . . . 0.722 ' HG3' ' O ' ' A' ' 204' ' ' PRO . 63.1 mt-10 -54.49 -37.62 65.49 Favored 'General case' 0 C--O 1.16 -3.644 0 O-C-N 120.432 -1.417 . . . . 72.55 112.156 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -67.04 -45.85 76.21 Favored 'General case' 1 CA--C 1.636 4.257 0 O-C-N 118.115 -2.866 . . . . 71.22 106.695 -175.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' TRP . . . . . . . . . . . . . 40.7 m95 -56.03 -46.54 78.8 Favored 'General case' 1 N--CA 1.366 -4.646 0 N-CA-C 112.84 0.681 . . . . 51.25 112.84 172.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' VAL . . . . . . . . . . . . . 36.4 t -69.52 -42.23 80.72 Favored 'Isoleucine or valine' 1 C--O 1.115 -6.001 0 N-CA-C 104.31 -2.478 . . . . 46.34 104.31 -174.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -61.3 -49.64 76.19 Favored 'General case' 0 C--O 1.155 -3.917 0 CA-C-N 122.273 2.306 . . . . 79.12 108.766 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' GLN . . . . . . . . . . . . . 41.4 tp60 -63.93 -46.44 84.74 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 104.551 -2.388 . . . . 51.26 104.551 -172.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 24.5 mt -69.5 -35.33 75.43 Favored 'General case' 0 C--O 1.161 -3.565 0 CA-C-N 119.234 0.924 . . . . 54.57 110.302 -176.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 21.4 mttm -70.18 -36.37 74.61 Favored 'General case' 0 C--O 1.163 -3.471 0 O-C-N 119.592 -1.942 . . . . 75.43 110.035 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.8 -53.74 54.34 Favored 'General case' 0 C--O 1.255 1.367 0 C-N-CA 125.01 1.324 . . . . 74.84 113.691 173.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' ILE . . . . . 0.405 HD12 HG23 ' A' ' 217' ' ' ILE . 35.4 mm -59.83 -36.88 69.01 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 123.845 0.858 . . . . 61.41 111.657 174.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 74.9 mt -75.54 -18.77 59.68 Favored 'General case' 0 C--O 1.291 3.287 0 O-C-N 120.325 -1.484 . . . . 79.01 111.216 -173.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' GLN . . . . . . . . . . . . 0.252 1.5 pt20 -138.72 -4.2 1.61 Allowed 'General case' 0 CA--C 1.467 -2.215 0 C-N-CA 115.484 -2.487 . . . . 94.03 113.056 -172.223 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ASP . . . . . 0.954 ' O ' HD23 ' A' ' 221' ' ' LEU . 13.1 m-20 -109.33 47.29 0.94 Allowed 'General case' 0 N--CA 1.381 -3.911 0 C-N-CA 113.304 -3.358 . . . . 93.3 113.737 167.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' LEU . . . . . 0.954 HD23 ' O ' ' A' ' 220' ' ' ASP . 4.3 mt -144.05 14.68 1.69 Allowed 'General case' 0 C--O 1.297 3.576 0 N-CA-C 105.886 -1.894 . . . . 81.68 105.886 179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 C--O 1.307 4.686 1 CA-C-O 107.802 -7.11 . . . . 82.35 118.509 -146.144 . . . . . . . . 2 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' PRO . . . . . 1.544 ' CG ' ' CB ' ' B' ' 14' ' ' PRO . 8.0 Cg_endo . . . . . 1 N--CA 1.622 9.069 0 N-CA-C 107.069 -1.935 . . . . 74.39 107.069 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -61.87 -41.65 98.1 Favored 'General case' 0 C--O 1.186 -2.283 0 N-CA-C 117.283 2.327 . . . . 87.07 117.283 162.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.55 -38.44 84.15 Favored 'General case' 0 N--CA 1.414 -2.242 0 C-N-CA 125.645 1.578 . . . . 74.64 108.862 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ILE . . . . . . . . . . . . . 32.3 mm -69.08 -48.1 71.32 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 CA-C-O 116.956 -1.497 . . . . 53.35 111.993 173.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . 0.261 81.0 mtm-85 -64.92 -25.85 68.06 Favored 'General case' 0 C--O 1.175 -2.861 0 C-N-CA 118.083 -1.447 . . . . 54.88 114.635 175.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -66.77 -39.08 87.72 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 118.797 -2.439 . . . . 53.41 113.03 172.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 63.8 tp -66.33 -48.85 68.93 Favored 'General case' 0 CA--C 1.447 -3.009 0 CA-C-O 117.807 -1.092 . . . . 47.67 108.474 175.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 96.8 mt -60.85 -29.09 69.3 Favored 'General case' 0 C--O 1.174 -2.903 0 N-CA-C 113.291 0.848 . . . . 45.54 113.291 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.81 -48.72 70.77 Favored 'General case' 0 N--CA 1.407 -2.59 0 C-N-CA 119.667 -0.813 . . . . 44.56 110.676 173.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' NZ ' ' A' ' 51' ' ' LYS . 86.8 m-20 -59.3 -35.76 74.37 Favored 'General case' 0 C--O 1.19 -2.075 0 C-N-CA 118.088 -1.445 . . . . 56.22 114.546 175.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 41.5 t -58.79 -56.57 15.89 Favored 'Isoleucine or valine' 1 C--O 1.147 -4.304 0 CA-C-N 115.666 -0.697 . . . . 46.98 111.502 176.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.94 -36.29 74.55 Favored 'General case' 0 CA--C 1.591 2.532 0 C-N-CA 125.927 1.691 . . . . 68.31 108.489 -175.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.8 m -68.93 -42.29 76.97 Favored 'General case' 1 C--O 1.139 -4.759 0 O-C-N 120.445 -1.409 . . . . 57.55 109.696 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -67.66 -60.29 2.66 Favored 'General case' 0 N--CA 1.402 -2.871 0 C-N-CA 124.142 0.977 . . . . 55.19 108.447 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' VAL . . . . . . . . . . . . . 95.7 t -61.78 -46.96 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.997 0 N-CA-C 108.594 -0.891 . . . . 57.98 108.594 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.47 -34.02 25.49 Favored 'General case' 0 C--O 1.179 -2.618 0 C-N-CA 117.458 -1.697 . . . . 63.93 111.996 -173.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -108.53 -54.98 2.44 Favored 'General case' 0 N--CA 1.522 3.134 0 O-C-N 118.881 -2.387 . . . . 76.54 115.95 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 14.4 m -54.27 -39.65 67.07 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 119.731 -1.856 . . . . 66.72 112.727 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 29.8 mt -85.18 -8.88 58.38 Favored 'General case' 0 N--CA 1.382 -3.825 0 O-C-N 119.964 -1.71 . . . . 66.35 110.803 -172.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 53.6 tttt -60.45 134.02 56.66 Favored 'General case' 1 C--O 1.334 5.547 0 O-C-N 119.643 -1.911 . . . . 85.49 112.704 178.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 41.26 63.01 1.67 Allowed Glycine 0 C--N 1.347 1.165 0 O-C-N 128.639 3.712 . . . . 75.89 116.372 -167.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.589 ' OE2' ' OG ' ' A' ' 38' ' ' SER . 28.5 mm-40 -115.73 160.77 19.65 Favored 'General case' 0 N--CA 1.436 -1.171 1 N-CA-C 99.506 -4.257 . . . . 76.74 99.506 177.159 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.92 66.35 4.35 Favored 'General case' 0 N--CA 1.392 -3.336 0 N-CA-C 119.167 3.025 . . . . 86.68 119.167 -175.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 33.8 mt -97.54 147.66 24.04 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.754 -0.832 . . . . 72.37 108.754 -158.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' SER . . . . . 0.423 ' OG ' ' OE2' ' A' ' 35' ' ' GLU . 4.1 p -75.29 176.4 7.44 Favored 'General case' 0 N--CA 1.395 -3.18 0 CA-C-N 119.455 1.025 . . . . 73.35 109.952 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' B' ' 43' ' ' GLU . 0.0 OUTLIER -59.08 -55.76 30.87 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 117.365 -1.302 . . . . 97.77 108.836 -174.84 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.577 ' N ' ' HG2' ' B' ' 39' ' ' LYS . 0.1 OUTLIER -56.75 -38.91 73.08 Favored 'General case' 0 CA--C 1.622 3.723 0 C-N-CA 127.761 2.424 . . . . 102.91 112.027 177.604 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -69.07 -33.56 73.74 Favored 'General case' 0 N--CA 1.404 -2.73 0 O-C-N 118.965 -2.335 . . . . 70.96 109.634 176.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' LYS . . . . . . . . . . . . . 16.5 mttp -70.62 -33.08 70.63 Favored 'General case' 1 C--O 1.137 -4.868 0 C-N-CA 119.645 -0.822 . . . . 85.19 110.819 -178.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' B' ' 39' ' ' LYS . 59.5 mt-10 -82.51 -39.15 22.82 Favored 'General case' 0 CA--C 1.432 -3.571 0 N-CA-C 104.475 -2.416 . . . . 87.86 104.475 -162.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -71.49 -35.89 70.95 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 127.917 3.26 . . . . 82.65 109.708 -179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -56.21 -47.79 77.71 Favored 'General case' 0 N--CA 1.432 -1.345 0 C-N-CA 117.534 -1.666 . . . . 61.46 112.05 173.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.73 -37.35 79.38 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.286 -0.87 . . . . 90.96 110.435 -171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 1.5 t -68.13 -38.87 82.67 Favored 'General case' 0 CA--C 1.622 3.723 0 CA-C-N 112.601 -2.09 . . . . 57.89 110.034 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.7 -42.67 90.91 Favored 'General case' 0 C--O 1.169 -3.14 0 C-N-CA 125.805 1.642 . . . . 57.91 112.656 169.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ILE . . . . . . . . . . . . . 3.4 mt -51.88 -49.91 35.27 Favored 'Isoleucine or valine' 0 C--O 1.156 -3.85 0 CA-C-N 121.349 1.886 . . . . 57.09 111.72 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -66.83 -37.56 84.74 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 106.155 -1.795 . . . . 88.02 106.155 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.3 -37.17 86.53 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.834 1.79 . . . . 54.91 115.834 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.55 -36.75 77.23 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.088 0 O-C-N 124.517 1.136 . . . . 58.87 112.541 176.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -68.24 -41.42 81.19 Favored 'General case' 0 C--O 1.169 -3.145 0 O-C-N 120.149 -1.594 . . . . 71.5 112.21 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -41.93 76.52 Favored 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 112.857 -3.449 . . . . 82.04 114.709 177.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 3.9 m -69.07 -28.15 38.08 Favored 'Isoleucine or valine' 1 N--CA 1.376 -4.134 0 O-C-N 126.378 2.299 . . . . 60.36 114.356 -178.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -43.82 -37.32 2.72 Favored 'General case' 0 N--CA 1.41 -2.467 0 N-CA-C 107.293 -1.373 . . . . 54.22 107.293 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 56.2 p -66.72 -16.46 64.25 Favored 'General case' 1 C--O 1.133 -5.032 0 CA-C-N 122.192 2.269 . . . . 58.4 113.977 -174.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . 0.297 42.3 t -72.38 -18.74 19.15 Favored 'Isoleucine or valine' 1 C--N 1.239 -4.203 0 O-C-N 117.233 -3.417 . . . . 62.78 112.308 178.699 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 -95.49 2.97 54.62 Favored 'General case' 0 N--CA 1.422 -1.847 0 O-C-N 118.127 -2.858 . . . . 56.9 109.941 179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.55 -50.91 30.17 Favored 'General case' 0 C--O 1.195 -1.813 0 N-CA-C 116.751 2.13 . . . . 66.62 116.751 172.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.588 ' HB2' ' O ' ' B' ' 226' ' ' HOH . 3.3 mt-30 -45.63 -40.34 8.88 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 122.808 1.29 . . . . 92.81 113.173 175.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -56.67 -28.11 60.09 Favored 'General case' 0 CA--C 1.61 3.259 0 O-C-N 119.582 -1.948 . . . . 78.12 114.274 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -101.26 -0.59 35.49 Favored 'General case' 0 C--O 1.166 -3.333 0 CA-C-O 114.739 -2.553 . . . . 63.94 112.206 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 127.188 2.195 . . . . 60.19 113.56 -178.946 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 CA--C 1.557 1.239 0 CA-C-O 125.692 2.663 . . . . 77.48 110.128 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_exo -56.35 151.58 43.86 Favored 'Trans proline' 0 C--O 1.17 -2.878 0 O-C-N 117.815 -1.729 . . . . 80.14 112.054 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' PRO . . . . . 0.507 ' O ' HD13 ' B' ' 109' ' ' ILE . 57.0 Cg_exo -55.17 141.96 79.09 Favored 'Trans proline' 0 C--O 1.17 -2.894 0 CA-C-O 113.871 -2.637 . . . . 75.25 110.472 163.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ILE . . . . . 1.411 ' CG1' ' CD1' ' B' ' 109' ' ' ILE . 27.0 mm -149.22 140.82 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 C-N-CA 127.584 2.354 . . . . 72.71 108.739 174.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' B' ' 232' ' ' HOH . . . -75.72 155.72 35.36 Favored 'General case' 0 C--O 1.177 -2.748 0 C-N-CA 118.581 -1.247 . . . . 73.55 110.131 177.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -51.09 -31.03 17.73 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 123.967 1.842 . . . . 77.91 113.371 -179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -99.96 -14.2 18.79 Favored 'General case' 1 C--O 1.114 -6.077 0 CA-C-N 113.386 -1.734 . . . . 92.03 109.575 -167.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -94.7 17.03 14.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 120.72 1.6 . . . . 75.63 107.254 174.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 15.1 mt -82.2 130.71 58.69 Favored Pre-proline 0 N--CA 1.494 1.741 0 C-N-CA 115.182 -2.607 . . . . 64.29 109.052 -172.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -85.13 130.54 4.07 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 124.62 3.547 . . . . 57.74 112.294 -177.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' PHE . . . . . . . . . . . . . 2.2 t80 68.86 59.1 0.37 Allowed 'General case' 0 N--CA 1.503 2.207 0 C-N-CA 125.375 1.47 . . . . 59.41 109.164 168.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' VAL . . . . . . . . . . . . . 47.4 t -79.1 101.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.683 0 CA-C-N 114.595 -1.184 . . . . 62.41 111.703 178.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 72.0 mt -70.48 -38.25 73.12 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.758 0 N-CA-C 113.336 0.865 . . . . 55.45 113.336 -178.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -156.09 150.12 25.31 Favored 'General case' 0 C--O 1.258 1.538 0 C-N-CA 129.277 3.031 . . . . 59.98 111.923 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ALA . . . . . . . . . . . . . . . -164.38 156.4 16.37 Favored 'General case' 1 C--O 1.127 -5.375 0 CA-C-N 114.259 -1.337 . . . . 56.54 109.398 -174.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLY . . . . . . . . . . . . . . . 166.85 156.34 9.61 Favored Glycine 1 C--O 1.163 -4.333 0 N-CA-C 115.681 1.032 . . . . 56.54 115.681 -163.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' TYR . . . . . . . . . . . . 0.251 39.4 m-85 -67.26 128.78 37.68 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 115.191 1.552 . . . . 68.26 115.191 160.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 17.1 mt -142.13 157.92 44.34 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.079 -1.452 . . . . 54.49 107.079 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLU . . . . . 0.493 ' HB2' ' HB ' ' B' ' 200' ' ' THR . 24.0 mt-10 -88.15 128.47 35.44 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.388 -1.278 . . . . 80.92 111.586 164.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 14.6 ttpp -112.89 144.7 42.0 Favored 'General case' 0 C--O 1.176 -2.778 0 O-C-N 120.159 -1.588 . . . . 73.78 107.841 -175.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . 0.371 56.6 ttp180 -146.42 151.29 37.2 Favored 'General case' 0 C--O 1.197 -1.686 0 C-N-CA 120.461 -0.496 . . . . 62.31 110.239 159.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 10.1 mtp180 -90.42 136.51 33.01 Favored 'General case' 0 C--O 1.252 1.205 0 O-C-N 121.072 -1.017 . . . . 56.72 109.818 169.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -60.36 -44.35 95.66 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 120.373 -0.531 . . . . 50.23 111.416 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -67.31 -21.35 65.68 Favored 'General case' 0 CA--C 1.476 -1.869 0 N-CA-C 114.859 1.429 . . . . 51.15 114.859 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -81.86 -39.09 24.44 Favored 'General case' 0 N--CA 1.428 -1.563 0 CA-C-O 114.734 -2.555 . . . . 58.85 112.394 169.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 97.7 p -54.78 -37.93 66.64 Favored 'General case' 0 C--O 1.207 -1.148 0 O-C-N 125.959 2.037 . . . . 58.44 115.39 175.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -50.18 -35.21 25.35 Favored 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 115.946 1.832 . . . . 48.3 115.946 169.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 87.4 mt -91.88 -1.32 57.38 Favored 'General case' 1 N--CA 1.376 -4.147 0 O-C-N 120.186 -1.571 . . . . 56.71 108.444 -173.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' GLY . . . . . . . . . . . . . . . 100.19 1.05 55.85 Favored Glycine 0 N--CA 1.411 -3.024 1 N-CA-C 124.256 4.462 . . . . 52.74 124.256 -177.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -72.84 130.97 41.63 Favored 'General case' 0 C--O 1.178 -2.708 0 N-CA-C 103.482 -2.784 . . . . 57.86 103.482 -175.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' B' ' 227' ' ' HOH . 2.2 tt0 -97.3 168.44 10.41 Favored 'General case' 0 C--N 1.272 -2.763 0 O-C-N 119.303 -2.123 . . . . 85.74 115.771 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -41.77 139.49 1.2 Allowed 'General case' 1 C--O 1.14 -4.678 0 C-N-CA 126.871 2.068 . . . . 56.37 115.91 169.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 79.7 mm-40 -135.05 136.35 42.0 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 119.838 -1.789 . . . . 70.99 109.804 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' LYS . . . . . 1.558 ' CE ' ' CD ' ' B' ' 139' ' ' LYS 0.309 16.3 mmtt -61.17 125.46 23.83 Favored 'General case' 0 C--O 1.192 -1.941 0 O-C-N 123.635 0.585 . . . . 79.95 109.707 173.756 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . 87.3 mmt-85 -134.57 137.98 44.21 Favored 'General case' 0 CA--C 1.572 1.797 0 O-C-N 125.255 1.597 . . . . 56.46 110.81 174.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -78.95 117.29 19.89 Favored 'General case' 0 N--CA 1.411 -2.418 0 N-CA-C 105.854 -1.906 . . . . 62.98 105.854 164.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.08 142.87 46.44 Favored 'General case' 0 C--O 1.183 -2.441 0 O-C-N 125.793 1.933 . . . . 55.58 110.854 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -142.84 120.71 11.98 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.365 -2.198 . . . . 62.43 111.511 -169.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' LEU . . . . . . . . . . . . . 47.0 tp -91.68 105.93 18.1 Favored 'General case' 0 C--N 1.273 -2.731 0 CA-C-O 123.798 1.761 . . . . 59.06 111.694 168.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 26.9 t -106.73 101.66 11.09 Favored 'General case' 1 C--O 1.151 -4.108 0 CA-C-N 112.273 -2.239 . . . . 55.96 106.926 -177.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' LYS . . . . . . . . . . . . . 16.2 mtmm 57.62 -123.16 1.56 Allowed 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 116.302 -1.809 . . . . 68.33 110.197 -166.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' THR . . . . . 0.404 ' OG1' ' O ' ' B' ' 230' ' ' HOH . 1.2 p -95.91 15.07 21.44 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 126.029 1.731 . . . . 72.41 112.843 177.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' VAL . . . . . . . . . . . . . 53.7 t -115.45 129.85 71.04 Favored 'Isoleucine or valine' 0 CA--C 1.442 -3.199 0 CA-C-N 119.921 1.237 . . . . 57.5 109.129 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -96.49 117.53 31.09 Favored 'General case' 0 C--O 1.279 2.637 0 CA-C-N 114.756 -1.111 . . . . 53.49 109.353 -179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -111.52 148.93 32.14 Favored 'General case' 0 C--O 1.287 3.048 0 N-CA-C 108.518 -0.919 . . . . 59.8 108.518 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -139.96 140.25 36.29 Favored 'General case' 0 C--O 1.286 3.001 0 C-N-CA 117.998 -1.481 . . . . 51.15 110.927 173.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -132.31 156.97 45.61 Favored 'General case' 0 C--O 1.292 3.313 0 N-CA-C 103.584 -2.747 . . . . 63.26 103.584 -168.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' GLY . . . . . . . . . . . . . . . -60.15 -44.11 97.69 Favored Glycine 0 C--N 1.354 1.544 0 CA-C-O 117.313 -1.826 . . . . 64.38 113.449 168.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 95.0 p -134.97 169.16 17.83 Favored 'General case' 2 N--CA 1.575 5.789 0 CA-C-N 120.06 1.93 . . . . 68.36 114.457 173.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 p30 -60.3 -21.74 62.34 Favored 'General case' 1 C--O 1.151 -4.127 0 N-CA-C 116.812 2.153 . . . . 73.89 116.812 171.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -93.7 -1.67 54.88 Favored 'General case' 0 C--O 1.181 -2.512 0 C-N-CA 127.215 2.206 . . . . 88.55 115.12 179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -70.75 165.78 22.31 Favored 'General case' 0 CA--C 1.499 -0.999 0 O-C-N 117.449 -3.282 . . . . 85.48 113.072 -171.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -95.23 -10.8 29.34 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 127.344 3.45 . . . . 96.43 109.161 -173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -164.39 141.28 6.45 Favored 'General case' 0 C--N 1.283 -2.286 0 O-C-N 117.878 -3.014 . . . . 87.51 104.226 -165.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 16.7 pm0 -76.17 138.3 40.59 Favored 'General case' 0 N--CA 1.499 1.987 0 CA-C-N 112.324 -2.216 . . . . 65.2 111.074 175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' LYS . . . . . . . . . . . . . 10.5 mttt -58.9 -28.93 66.64 Favored 'General case' 0 C--O 1.2 -1.542 0 CA-C-O 123.449 1.595 . . . . 83.81 112.626 161.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLY . . . . . . . . . . . . . . . 172.0 -174.6 45.35 Favored Glycine 0 C--O 1.266 2.119 0 CA-C-O 123.607 1.67 . . . . 55.28 110.08 176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -177.13 160.96 1.81 Allowed 'General case' 0 C--O 1.25 1.095 0 CA-C-N 112.372 -1.914 . . . . 60.2 113.745 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -151.81 141.31 21.63 Favored 'General case' 0 C--O 1.169 -3.173 0 CA-C-O 123.534 1.635 . . . . 51.96 108.729 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -80.61 133.13 35.71 Favored 'General case' 0 N--CA 1.414 -2.242 0 N-CA-C 106.885 -1.524 . . . . 52.59 106.885 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 pt -92.17 1.59 8.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 N-CA-C 115.71 1.744 . . . . 56.41 115.71 -170.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -56.44 128.6 36.85 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 116.507 -2.077 . . . . 64.23 111.1 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' GLY . . . . . . . . . . . . . . . 77.67 15.56 81.17 Favored Glycine 0 C--O 1.191 -2.564 0 N-CA-C 116.179 1.232 . . . . 55.8 116.179 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' TYR . . . . . 0.436 ' HD2' HG22 ' B' ' 189' ' ' ILE . 3.3 m-85 -91.41 165.83 13.2 Favored 'General case' 1 C--O 1.148 -4.244 0 N-CA-C 102.113 -3.291 . . . . 58.78 102.113 -174.201 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -117.3 166.4 12.33 Favored 'General case' 0 C--O 1.168 -3.219 0 N-CA-C 114.475 1.287 . . . . 82.44 114.475 160.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 14.4 p -147.1 143.23 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.737 0 O-C-N 124.614 1.196 . . . . 60.08 109.31 -175.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' ARG . . . . . . . . . . . . . 9.5 ptt180 -161.06 152.26 18.85 Favored 'General case' 0 N--CA 1.406 -2.635 0 N-CA-C 114.101 1.149 . . . . 71.66 114.101 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' MET . . . . . . . . . . . . . 86.6 mmm -74.27 147.32 42.47 Favored 'General case' 0 C--O 1.162 -3.54 0 N-CA-C 107.207 -1.405 . . . . 74.52 107.207 173.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -152.02 95.93 2.14 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-N 119.475 1.034 . . . . 67.75 109.432 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' ASN . . . . . 0.421 ' C ' ' OD1' ' B' ' 175' ' ' ASN . 39.9 p30 -88.16 11.84 15.26 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 117.658 -1.163 . . . . 86.7 108.114 -172.029 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' THR . . . . . . . . . . . . . 10.7 p -98.66 30.03 3.46 Favored 'General case' 0 C--O 1.165 -3.372 0 N-CA-C 116.204 1.927 . . . . 86.83 116.204 170.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 29.4 mt -119.39 -13.54 9.25 Favored 'General case' 0 C--O 1.201 -1.461 0 CA-C-N 124.669 3.395 . . . . 83.78 110.901 -169.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 39.6 mtp85 -125.85 134.41 51.65 Favored 'General case' 1 C--O 1.321 4.839 0 N-CA-C 115.757 1.762 . . . . 94.32 115.757 172.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' B' ' 179' ' ' LYS . 13.3 tttt -84.51 77.97 9.92 Favored 'General case' 0 CA--C 1.588 2.415 0 N-CA-C 104.597 -2.372 . . . . 108.46 104.597 165.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' ASP . . . . . 0.552 ' HB3' ' H ' ' B' ' 182' ' ' LYS . 0.8 OUTLIER -152.77 178.27 9.82 Favored 'General case' 0 CA--C 1.444 -3.105 0 N-CA-C 103.357 -2.831 . . . . 106.81 103.357 -168.562 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.02 -4.34 84.5 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 108.171 -1.971 . . . . 104.27 108.171 165.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' LYS . . . . . 0.552 ' H ' ' HB3' ' B' ' 180' ' ' ASP . 3.5 mppt? -88.41 16.39 6.5 Favored 'General case' 0 C--O 1.2 -1.526 0 C-N-CA 125.789 1.636 . . . . 111.26 113.603 171.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' LYS . . . . . . . . . . . . . 6.2 pttp -79.45 -31.18 42.45 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 119.143 3.016 . . . . 111.09 119.143 -168.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.37 -5.05 37.23 Favored 'General case' 0 C--O 1.304 3.933 0 C-N-CA 125.992 1.717 . . . . 108.21 114.018 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' CYS . . . . . 0.433 ' HB3' ' HA ' ' B' ' 204' ' ' PRO 0.268 1.7 p -116.62 42.59 2.41 Favored 'General case' 0 CA--C 1.571 1.76 1 N-CA-C 125.711 5.449 . . . . 83.12 125.711 174.218 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' CYS . . . . . . . . . . . . . 71.2 m -114.8 160.34 19.55 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.106 -1.861 . . . . 65.09 113.808 168.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -153.73 171.3 19.07 Favored 'General case' 0 C--O 1.197 -1.673 0 CA-C-O 116.894 -1.527 . . . . 53.96 110.133 170.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -132.09 151.51 51.73 Favored 'General case' 1 N--CA 1.367 -4.593 0 C-N-CA 124.278 1.031 . . . . 58.4 109.39 178.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' ILE . . . . . 0.436 HG22 ' HD2' ' B' ' 169' ' ' TYR . 73.4 mt -117.1 125.94 74.2 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.177 0 C-N-CA 126.461 1.904 . . . . 55.51 108.276 168.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' CYS . . . . . . . . . . . . . 74.1 m -115.85 117.27 29.73 Favored 'General case' 0 N--CA 1.4 -2.958 0 CA-C-O 122.259 1.028 . . . . 58.24 109.059 -167.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' ALA . . . . . . . . . . . . . . . -79.97 154.13 75.17 Favored Pre-proline 0 N--CA 1.403 -2.781 0 N-CA-C 117.285 2.328 . . . . 53.46 117.285 173.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -52.13 -40.95 67.62 Favored 'Trans proline' 0 C--O 1.181 -2.362 0 CA-C-O 112.302 -3.291 . . . . 61.34 115.986 171.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' ASP . . . . . 0.546 ' O ' ' HB2' ' B' ' 194' ' ' LYS . 0.9 OUTLIER -66.59 0.86 2.01 Favored 'General case' 0 CA--C 1.56 1.345 0 O-C-N 126.432 2.333 . . . . 86.12 114.43 170.873 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' LYS . . . . . 0.546 ' HB2' ' O ' ' B' ' 193' ' ' ASP . 0.8 OUTLIER 86.27 3.81 0.49 Allowed 'General case' 0 C--O 1.16 -3.649 0 CA-C-O 124.068 1.89 . . . . 77.4 115.648 172.337 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' ARG . . . . . . . . . . . . . 43.4 ttm180 -69.08 136.92 53.03 Favored 'General case' 0 C--O 1.167 -3.276 0 O-C-N 119.837 -1.789 . . . . 59.31 113.809 168.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' ILE . . . . . . . . . . . . . 96.1 mt -131.17 127.45 60.64 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.435 0 CA-C-O 123.698 1.713 . . . . 47.68 110.645 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -107.32 119.43 39.38 Favored 'General case' 0 C--N 1.263 -3.172 0 CA-C-O 125.849 2.738 . . . . 59.39 105.57 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -108.68 141.42 40.67 Favored 'General case' 0 C--N 1.268 -2.962 0 O-C-N 119.989 -1.695 . . . . 46.6 106.879 -176.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' PHE . . . . . 0.437 ' HA ' ' O ' ' B' ' 124' ' ' GLU . 95.7 m-85 -131.57 147.75 52.56 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-O 123.489 1.614 . . . . 54.43 109.357 179.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' B' ' 124' ' ' GLU . 76.9 m -112.21 130.21 56.0 Favored 'General case' 0 C--O 1.196 -1.715 0 CA-C-N 113.963 -1.472 . . . . 60.29 109.498 163.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ALA . . . . . . . . . . . . . . . -100.65 173.29 6.61 Favored 'General case' 1 C--O 1.117 -5.875 0 O-C-N 121.449 -0.782 . . . . 68.44 110.87 177.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' ALA . . . . . . . . . . . . . . . -78.54 -10.96 59.92 Favored 'General case' 0 C--O 1.169 -3.159 0 C-N-CA 126.026 1.73 . . . . 73.72 112.322 -176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 61.4 p -165.0 166.1 11.28 Favored Pre-proline 0 N--CA 1.506 2.334 0 CA-C-N 122.129 2.241 . . . . 72.46 105.567 169.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' PRO . . . . . 0.433 ' HA ' ' HB3' ' B' ' 185' ' ' CYS . 37.4 Cg_exo -61.24 -29.33 86.29 Favored 'Trans proline' 0 CA--C 1.561 1.826 0 CA-C-O 126.475 2.614 . . . . 73.11 114.89 -178.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' LYS . . . . . . . . . . . . . 15.8 tttt -69.66 -42.53 74.07 Favored 'General case' 0 N--CA 1.416 -2.148 0 CA-C-N 111.903 -2.408 . . . . 98.82 104.988 -178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -64.61 -43.52 93.49 Favored 'General case' 0 N--CA 1.508 2.453 0 C-N-CA 125.413 1.485 . . . . 83.95 109.757 -174.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' ALA . . . . . . . . . . . . . . . -55.22 -55.68 28.5 Favored 'General case' 0 N--CA 1.4 -2.95 0 N-CA-C 113.586 0.958 . . . . 64.71 113.586 172.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -58.14 -34.06 69.86 Favored 'General case' 0 CA--C 1.486 -1.487 0 C-N-CA 123.689 0.795 . . . . 98.21 111.117 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -64.76 -44.64 89.41 Favored 'General case' 0 C--O 1.165 -3.371 0 N-CA-C 114.297 1.221 . . . . 85.31 114.297 173.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -60.19 -43.58 95.79 Favored 'General case' 0 N--CA 1.432 -1.334 0 N-CA-C 113.202 0.816 . . . . 58.15 113.202 173.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.31 -50.09 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 CA-C-O 117.516 -1.231 . . . . 53.41 113.835 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 -54.49 -51.46 65.0 Favored 'General case' 0 N--CA 1.434 -1.24 0 O-C-N 124.849 1.343 . . . . 94.75 110.038 176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -60.45 -42.19 95.63 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 113.98 -1.464 . . . . 57.7 110.743 179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.49 -42.43 68.07 Favored 'General case' 0 CA--C 1.566 1.583 0 C-N-CA 117.224 -1.791 . . . . 59.97 107.928 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 24.6 mttt -60.93 -39.68 90.34 Favored 'General case' 0 C--O 1.282 2.795 0 CA-C-O 117.371 -1.299 . . . . 79.22 109.306 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -55.48 -50.48 69.79 Favored 'General case' 0 C--O 1.178 -2.686 0 O-C-N 127.103 2.752 . . . . 79.05 116.48 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.74 -42.89 93.44 Favored 'Isoleucine or valine' 1 C--O 1.127 -5.387 0 O-C-N 119.601 -1.937 . . . . 65.25 111.709 172.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 45.3 mt -70.57 -0.09 7.87 Favored 'General case' 0 C--O 1.195 -1.811 0 CA-C-N 120.588 1.54 . . . . 79.21 109.852 -174.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -134.03 -49.56 0.81 Allowed 'General case' 1 CA--C 1.414 -4.259 0 CA-C-O 117.46 -1.257 . . . . 92.27 113.954 -172.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' ASP . . . . . 1.146 ' HB2' ' O ' ' B' ' 231' ' ' HOH 0.279 0.6 OUTLIER -116.85 72.16 0.82 Allowed 'General case' 0 C--N 1.296 -1.734 0 C-N-CA 112.146 -3.822 . . . . 115.37 115.943 177.37 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' LEU . . . . . . . . . . . . 0.286 0.0 OUTLIER -126.26 -56.8 1.42 Allowed 'General case' 0 N--CA 1.4 -2.97 3 CA-C-N 105.364 -5.38 . . . . 96.38 101.164 159.792 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.746 0 CA-C-N 114.693 -1.14 . . . . 95.09 111.581 171.062 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . 0.738 ' O ' HG22 ' A' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . 1.093 ' O ' ' HG2' ' A' ' 136' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . 0.45 ' O ' ' HG3' ' A' ' 61' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . 0.656 ' O ' ' C ' ' A' ' 64' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . 0.495 ' O ' ' HD3' ' A' ' 40' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' HOH . . . . . 0.588 ' O ' ' HB2' ' B' ' 61' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' HOH . . . . . 0.456 ' O ' ' HA ' ' B' ' 136' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HOH . . . . . 0.404 ' O ' ' OG1' ' B' ' 147' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' HOH . . . . . 1.146 ' O ' ' HB2' ' B' ' 220' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' HOH . . . . . 0.409 ' O ' ' HB1' ' B' ' 110' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_