data_2jw4_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 2jw4 _Structure_validation_residue.Date_analyzed 2016-10-07 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 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.417 ' CG1' HD23 ' A' ' 34' ' ' LEU . 32.4 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.838 0.351 . . . . 75.420000000000002 111.115 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' N ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 111.087 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.461 ' N ' HG23 ' A' ' 9' ' ' VAL . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 74.040000000000006 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.439999999999998 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.129999999999995 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.430000000000007 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.299999999999997 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 74.209999999999994 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.329999999999998 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.329999999999998 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.299999999999997 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.519999999999996 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 63.240000000000002 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.329999999999998 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.140000000000001 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.887 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.886 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.409999999999997 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 74.450000000000003 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.129999999999995 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.239999999999995 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 75.109999999999999 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.439999999999998 110.958 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.310000000000002 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.417 HD23 ' CG1' ' A' ' 8' ' ' VAL . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.401 ' CD1' HG22 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.219999999999999 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 75.209999999999994 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.415 ' CG ' HD22 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.409999999999997 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.219999999999999 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 72.140000000000001 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.519999999999996 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.340000000000003 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 75.329999999999998 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.420000000000002 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 74.140000000000001 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.310000000000002 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.349999999999994 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.040000000000006 110.828 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.219999999999999 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.109999999999999 110.93 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.401 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 71.329999999999998 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 71.019999999999996 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 74.329999999999998 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.439999999999998 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.049999999999997 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.329999999999998 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.402 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 73.510000000000005 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.416 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.409999999999997 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.510000000000005 110.825 -179.867 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.831 0.348 . . . . 72.25 111.14 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 73.519999999999996 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG1' HD11 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.451 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 75.409999999999997 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 64.239999999999995 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.452 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.439999999999998 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.452 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.150000000000006 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.510000000000005 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.508 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.530000000000001 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.508 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 72.099999999999994 110.907 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.010000000000005 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.019999999999996 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.099999999999994 110.869 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.150000000000006 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 74.109999999999999 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.454 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.109999999999999 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 74.510000000000005 110.923 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 71.140000000000001 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 71.209999999999994 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.450000000000003 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 72.409999999999997 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.299999999999997 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.54 HD12 ' CE3' ' A' ' 42' ' ' TRP . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.209999999999994 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.463 ' N ' HD21 ' A' ' 34' ' ' LEU . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.430000000000007 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.299999999999997 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.518 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.520000000000003 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.030000000000001 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.454 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.010000000000005 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.54 ' CE3' HD12 ' A' ' 34' ' ' LEU . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.140000000000001 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.476 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.030000000000001 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.510000000000005 111.148 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.140000000000001 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 74.140000000000001 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 62.530000000000001 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.420000000000002 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.446 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.310000000000002 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 74.030000000000001 112.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 75.530000000000001 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 75.209999999999994 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 75.439999999999998 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 72.109999999999999 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.540000000000006 111.14 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.230000000000004 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 74.510000000000005 110.837 -179.897 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.912 0.387 . . . . 72.510000000000005 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 74.209999999999994 111.133 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.46 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.329999999999998 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.459 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 74.129999999999995 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.458 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.430000000000007 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.129999999999995 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.530000000000001 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.503 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.010000000000005 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 74.109999999999999 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.503 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.040000000000006 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.109999999999999 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.409999999999997 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.109999999999999 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.406 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 73.329999999999998 110.816 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 73.299999999999997 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.439999999999998 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.310000000000002 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.404 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 73.450000000000003 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 75.230000000000004 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.409999999999997 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 110.843 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 62.229999999999997 110.878 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.468 ' CD1' HG22 ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.310000000000002 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.219999999999999 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.430000000000007 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.340000000000003 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.415 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.200000000000003 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.43 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.019999999999996 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.140000000000001 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 70.140000000000001 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.230000000000004 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 73.200000000000003 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.510000000000005 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.140000000000001 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.468 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.230000000000004 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.404 ' C ' HG12 ' A' ' 54' ' ' VAL . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.329999999999998 110.873 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.404 HG12 ' C ' ' A' ' 53' ' ' PHE . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 72.25 111.163 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.520000000000003 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.540000000000006 110.895 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.400000000000006 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 73.319999999999993 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.46 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.510000000000005 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.882 -179.909 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.466 ' CG1' HD21 ' A' ' 34' ' ' LEU . 61.8 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.911 0.386 . . . . 65.200000000000003 111.131 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.230000000000004 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.409 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.209999999999994 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.474 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 74.420000000000002 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 64.510000000000005 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 73.010000000000005 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.503 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.010000000000005 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.450000000000003 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.539 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.040000000000006 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.463 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 73.140000000000001 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.129999999999995 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 70.120000000000005 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.439999999999998 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.420000000000002 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.540000000000006 110.94 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.454 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 73.329999999999998 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 65.120000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.219999999999999 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 73.430000000000007 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD21 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.466 HD21 ' CG1' ' A' ' 8' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.449 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.340000000000003 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 71.219999999999999 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 110.824 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.299999999999997 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.239999999999995 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.450000000000003 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.400000000000006 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.340000000000003 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.505 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 73.5 111.157 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.849 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.432 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 74.439999999999998 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 72.329999999999998 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 72.150000000000006 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.449 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 74.0 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 51.409999999999997 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.505 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.519999999999996 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.419 HG12 ' C ' ' A' ' 53' ' ' PHE . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 73.340000000000003 111.148 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.520000000000003 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.230000000000004 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.539 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.239999999999995 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.409 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 64.299999999999997 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.109999999999999 110.845 -179.91 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.851 0.358 . . . . 74.129999999999995 111.106 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.239999999999995 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.466 ' CG1' HD11 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 71.120000000000005 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 74.329999999999998 111.146 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.239999999999995 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 73.420000000000002 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.200000000000003 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.420000000000002 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.527 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 75.310000000000002 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.430000000000007 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.834 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 74.310000000000002 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.150000000000006 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.510000000000005 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.91 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.834 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.402 HD11 ' N ' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.549999999999997 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.040000000000006 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.453 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.450000000000003 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.401 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 74.109999999999999 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 74.140000000000001 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.230000000000004 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.539999999999999 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.422 ' C ' HD23 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.467 ' N ' HD23 ' A' ' 32' ' ' LEU . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 70.230000000000004 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 71.129999999999995 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.54 HD12 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.468 ' N ' HD21 ' A' ' 34' ' ' LEU . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 73.109999999999999 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.219999999999999 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 110.824 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.140000000000001 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.140000000000001 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.299999999999997 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 72.239999999999995 110.937 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.54 ' CE3' HD12 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.120000000000005 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.140000000000001 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 73.310000000000002 111.165 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 64.319999999999993 110.85 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.010000000000005 110.942 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.400000000000006 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.239999999999995 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.552 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.219999999999999 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.150000000000006 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.431 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.120000000000005 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.402 ' N ' HD11 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.299999999999997 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.319999999999993 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.150000000000006 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.209999999999994 112.365 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.420000000000002 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.109999999999999 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.409 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.149999999999999 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.030000000000001 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 72.219999999999999 110.903 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.464 HG12 ' CD2' ' A' ' 34' ' ' LEU . 70.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 74.239999999999995 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.510000000000005 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.466 HG22 ' CG2' ' A' ' 59' ' ' VAL . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.299999999999997 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.099999999999994 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.349999999999994 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.519999999999996 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 73.540000000000006 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.549999999999997 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.109999999999999 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 74.530000000000001 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 74.340000000000003 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.010000000000005 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 74.030000000000001 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 65.209999999999994 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 73.019999999999996 110.89 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 110.96 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.436 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.540000000000006 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.450000000000003 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.340000000000003 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 73.450000000000003 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.109999999999999 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.450000000000003 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.420000000000002 110.918 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.540000000000006 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.464 ' CD2' HG12 ' A' ' 8' ' ' VAL . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.415 ' CD1' HG22 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 74.439999999999998 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.510000000000005 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.426 ' CG ' HD23 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.310000000000002 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.099999999999994 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 71.349999999999994 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.420000000000002 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.409999999999997 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 75.150000000000006 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.524 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.41 ' O ' ' CG2' ' A' ' 51' ' ' THR . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.129999999999995 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 110.869 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 74.209999999999994 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.310000000000002 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.099999999999994 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.415 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.430000000000007 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.109999999999999 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.430000000000007 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.400000000000006 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.310000000000002 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.450000000000003 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.466 ' CG2' HG22 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.510000000000005 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.429 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HG2' ' CG1' ' A' ' 8' ' ' VAL . 27.2 mtm105 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.150000000000006 110.888 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.838 0.351 . . . . 65.25 111.154 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.549999999999997 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 72.099999999999994 111.127 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.408 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 75.420000000000002 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 70.209999999999994 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.049999999999997 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.52 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 75.140000000000001 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.439999999999998 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 74.140000000000001 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.655 ' CB ' ' HE2' ' A' ' 23' ' ' GLU . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.549999999999997 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.109999999999999 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.239999999999995 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.150000000000006 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.655 ' HE2' ' CB ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 74.040000000000006 110.91 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 73.239999999999995 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.461 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.401 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 75.239999999999995 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 74.310000000000002 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.099999999999994 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.129999999999995 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.408 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 73.510000000000005 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.467 ' CD1' ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 72.120000000000005 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.404 HD23 ' CG ' ' A' ' 37' ' ' ASP . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.406 ' CD1' HG23 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 75.120000000000005 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 74.219999999999999 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.404 ' CG ' HD23 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.219999999999999 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 74.299999999999997 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 72.129999999999995 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 73.129999999999995 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.416 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 72.219999999999999 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 70.409999999999997 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.219999999999999 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 65.040000000000006 111.083 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.467 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.420000000000002 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.400000000000006 110.852 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.349999999999994 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.897 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.406 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.340000000000003 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.109999999999999 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 74.239999999999995 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.030000000000001 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.416 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 70.540000000000006 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 73.299999999999997 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 71.319999999999993 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.030000000000001 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.319999999999993 111.192 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 63.119999999999997 110.907 -179.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.439 ' CG1' HD23 ' A' ' 34' ' ' LEU . 94.8 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.935 0.398 . . . . 72.319999999999993 111.076 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.319999999999993 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.425 ' HB ' ' C ' ' A' ' 60' ' ' GLU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.329999999999998 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.464 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 75.549999999999997 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.099999999999994 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.478 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.420000000000002 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.478 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.409999999999997 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.120000000000005 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.531 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 74.109999999999999 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.329999999999998 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.200000000000003 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.329999999999998 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.239999999999995 110.956 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.891 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 72.349999999999994 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.200000000000003 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 74.329999999999998 110.876 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.310000000000002 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.42 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 75.219999999999999 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.019999999999996 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.439 HD23 ' CG1' ' A' ' 8' ' ' VAL . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.519999999999996 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.423 HD12 ' CG2' ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.420000000000002 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.209999999999994 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.129999999999995 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.319999999999993 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.030000000000001 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.497 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.319999999999993 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.464 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.41 ' O ' ' CG2' ' A' ' 51' ' ' THR . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.912 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 63.520000000000003 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 55.32 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.466 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.200000000000003 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 54.219999999999999 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 75.030000000000001 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.423 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.239999999999995 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.140000000000001 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.299999999999997 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.140000000000001 111.126 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.497 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.119999999999997 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.109999999999999 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 75.299999999999997 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 72.439999999999998 111.167 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.425 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.549999999999997 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.439999999999998 110.864 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.867 0.365 . . . . 74.439999999999998 111.096 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 111.115 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 72.549999999999997 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.485 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 111.042 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.409999999999997 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.439999999999998 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.219999999999999 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.517 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.420000000000002 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 70.120000000000005 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.422 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.350000000000001 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.638 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.319999999999993 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.439999999999998 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.638 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.210000000000001 110.944 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.451 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 72.349999999999994 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 73.140000000000001 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.219999999999999 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 74.430000000000007 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 54.149999999999999 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 74.430000000000007 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.466 ' N ' HD21 ' A' ' 32' ' ' LEU . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.299999999999997 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.528 HD11 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.010000000000005 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.408 ' N ' HD22 ' A' ' 34' ' ' LEU . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 72.209999999999994 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.496 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.210000000000001 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.400000000000006 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 71.25 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.487 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 74.329999999999998 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE3' HD11 ' A' ' 34' ' ' LEU . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.140000000000001 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.529 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.540000000000006 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.510000000000005 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.040000000000006 110.86 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.929 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.439999999999998 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.209999999999994 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.120000000000005 111.158 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.467 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.340000000000003 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 74.219999999999999 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.423 HG13 ' C ' ' A' ' 53' ' ' PHE . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.120000000000005 111.112 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.49 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.329999999999998 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.229999999999997 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.299999999999997 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.517 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 61.140000000000001 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.5 111.118 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.319999999999993 110.872 -179.935 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 42.3 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.888 0.375 . . . . 74.129999999999995 111.108 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.530000000000001 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.462 HG22 ' CG2' ' A' ' 59' ' ' VAL . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.010000000000005 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 64.239999999999995 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.219999999999999 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.536 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 73.349999999999994 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.400000000000006 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 70.200000000000003 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.482 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 72.510000000000005 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 71.310000000000002 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.240000000000002 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 73.200000000000003 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.530000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.230000000000004 110.969 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 52.329999999999998 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.412 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.239999999999995 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.310000000000002 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.412 ' C ' HD21 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.412 HD21 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 73.140000000000001 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.219999999999999 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.429 ' N ' ' O ' ' A' ' 8' ' ' VAL . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.409999999999997 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.467 ' CD1' HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.409999999999997 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.422 ' OD2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 73.329999999999998 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.129999999999995 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 75.140000000000001 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.310000000000002 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.413 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.019999999999996 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.030000000000001 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 75.319999999999993 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.420000000000002 110.873 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.299999999999997 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.219999999999999 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.299999999999997 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.56 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.340000000000003 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.467 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 73.450000000000003 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 74.319999999999993 112.501 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 74.239999999999995 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 73.150000000000006 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 73.120000000000005 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 65.329999999999998 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.409999999999997 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.409999999999997 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.462 ' CG2' HG22 ' A' ' 10' ' ' VAL . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.209999999999994 111.118 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.418 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.010000000000005 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' N ' HG11 ' A' ' 10' ' ' VAL . 74.3 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.885 0.374 . . . . 74.450000000000003 111.128 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.403 ' C ' HG13 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.510000000000005 111.127 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.449 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 64.439999999999998 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.45 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.400000000000006 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 71.530000000000001 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 73.540000000000006 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.539999999999999 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.239999999999995 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 74.540000000000006 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' C ' ' A' ' 23' ' ' GLU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.140000000000001 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.420000000000002 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.430000000000007 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 73.420000000000002 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.42 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.430000000000007 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.456 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.239999999999995 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.329999999999998 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.409999999999997 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.109999999999999 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.319999999999993 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 72.430000000000007 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.461 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.430000000000007 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.411 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.420000000000002 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 74.409999999999997 110.951 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.469 ' CD1' HG23 ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 71.450000000000003 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 63.399999999999999 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 73.239999999999995 110.87 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 64.209999999999994 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.129999999999995 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.4 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.319999999999993 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.420000000000002 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 74.430000000000007 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.219999999999999 111.094 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.129999999999995 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.310000000000002 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.519999999999996 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.577 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 75.349999999999994 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.469 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 74.099999999999994 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.439999999999998 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 73.430000000000007 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 65.150000000000006 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.4 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.099999999999994 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.409999999999997 110.883 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.519999999999996 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 73.519999999999996 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.449 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.349999999999994 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.200000000000003 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.310000000000002 110.937 -179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.872 0.368 . . . . 74.340000000000003 111.082 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.412 ' C ' HG11 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.140000000000001 111.132 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 70.319999999999993 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.434 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.120000000000005 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.020000000000003 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 75.120000000000005 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.420000000000002 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.219999999999999 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 74.530000000000001 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.419 ' O ' ' C ' ' A' ' 19' ' ' GLN . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.420000000000002 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.120000000000005 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.099999999999994 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.409 ' C ' ' HA3' ' A' ' 52' ' ' GLY . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.400000000000006 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.484 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.209999999999994 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.239999999999995 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 71.219999999999999 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 74.420000000000002 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.434 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 71.230000000000004 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.47 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.040000000000006 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.400000000000006 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.465 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 72.230000000000004 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.457 HD12 ' CG2' ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 75.140000000000001 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.049999999999997 110.929 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 65.209999999999994 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.140000000000001 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.230000000000004 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.41 ' CE3' HD13 ' A' ' 34' ' ' LEU . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 75.340000000000003 110.905 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.140000000000001 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' CG2' ' A' ' 51' ' ' THR . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.129999999999995 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.109999999999999 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.459 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.439999999999998 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.129999999999995 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.109999999999999 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.474 ' CA ' HD11 ' A' ' 24' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.420000000000002 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.484 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.130000000000003 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.536 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 64.140000000000001 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.340000000000003 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.200000000000003 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 61.409999999999997 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 75.219999999999999 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 71.439999999999998 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 75.230000000000004 110.945 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 75.219999999999999 110.932 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.462 ' CG1' HD23 ' A' ' 34' ' ' LEU . 87.4 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.849 0.357 . . . . 75.25 111.226 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 75.510000000000005 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.456 HG13 ' N ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.150000000000006 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.329999999999998 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 75.230000000000004 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.439999999999998 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 73.150000000000006 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.129999999999995 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.475 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 73.510000000000005 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 74.439999999999998 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.475 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.430000000000007 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.219999999999999 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.439999999999998 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.340000000000003 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.349999999999994 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 75.420000000000002 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.310000000000002 110.929 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 72.150000000000006 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 65.219999999999999 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.530000000000001 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.349999999999994 110.828 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.415 HD23 ' N ' ' A' ' 32' ' ' LEU . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 73.319999999999993 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.120000000000005 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.462 HD23 ' CG1' ' A' ' 8' ' ' VAL . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 75.140000000000001 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.447 ' CD1' HG22 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 75.299999999999997 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.439999999999998 110.843 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 52.329999999999998 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.409999999999997 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.439999999999998 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.413 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 75.209999999999994 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 74.549999999999997 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 73.140000000000001 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.430000000000007 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 72.140000000000001 110.86 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 73.519999999999996 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.565 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 72.0 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.447 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.239999999999995 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.549999999999997 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.415 HG11 ' C ' ' A' ' 53' ' ' PHE . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 74.519999999999996 111.105 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.329999999999998 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 72.439999999999998 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 73.530000000000001 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.456 ' CG2' HG23 ' A' ' 10' ' ' VAL . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.140000000000001 111.154 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.239999999999995 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.456 ' N ' HG13 ' A' ' 10' ' ' VAL . 8.7 mtm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.049999999999997 110.86 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.456 ' CG1' HD23 ' A' ' 34' ' ' LEU . 40.3 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.841 0.353 . . . . 71.230000000000004 111.098 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 74.340000000000003 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.422 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 64.439999999999998 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.417 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.239999999999995 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.563 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.409999999999997 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.563 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 74.319999999999993 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.340000000000003 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.099999999999994 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 73.219999999999999 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.4 ' HB1' ' C ' ' A' ' 23' ' ' GLU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.420000000000002 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 74.340000000000003 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 65.420000000000002 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.4 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.540000000000006 110.871 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 75.019999999999996 110.895 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.310000000000002 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.467 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.120000000000005 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.430000000000007 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.430000000000007 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.430000000000007 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.417 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.299999999999997 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 72.25 110.923 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.530000000000001 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.456 HD23 ' CG1' ' A' ' 8' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.954 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.019999999999996 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.438 ' OD2' ' N ' ' A' ' 37' ' ' ASP . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 74.150000000000006 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.129999999999995 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.140000000000001 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.319999999999993 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.430000000000007 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.558 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.349999999999994 111.105 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.439999999999998 110.883 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.239999999999995 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 72.510000000000005 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 73.120000000000005 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 71.310000000000002 111.203 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.558 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.540000000000006 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.230000000000004 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.340000000000003 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.239999999999995 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 74.230000000000004 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.422 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.209999999999994 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 110.946 -179.942 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 18.2 t . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.855 0.359 . . . . 73.329999999999998 111.064 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.475 HG22 ' N ' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.430000000000007 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.475 ' N ' HG22 ' A' ' 9' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.540000000000006 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.403 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 62.109999999999999 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.230000000000004 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.150000000000006 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.109999999999999 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.319999999999993 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.230000000000004 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.1 mm-40 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.010000000000005 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 72.109999999999999 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 72.409999999999997 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.040000000000006 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.439 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.329999999999998 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.450000000000003 110.946 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.129999999999995 110.879 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.209999999999994 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 71.349999999999994 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.099999999999994 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.229999999999997 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.403 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.230000000000004 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.239999999999995 110.947 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.219999999999999 110.896 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.445 ' CD1' HG22 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.420000000000002 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 72.420000000000002 110.791 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.109999999999999 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 74.200000000000003 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.487 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.209999999999994 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 74.120000000000005 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.450000000000003 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.904 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.219999999999999 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.129999999999995 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.150000000000006 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.200000000000003 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 65.420000000000002 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 75.310000000000002 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.420000000000002 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.487 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.020000000000003 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 73.329999999999998 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 73.519999999999996 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.0 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.473 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 74.409999999999997 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.42 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 75.219999999999999 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.855 -179.902 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.342 . . . . 73.409999999999997 111.173 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 72.430000000000007 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.432 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 62.100000000000001 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.510000000000005 111.083 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.200000000000003 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.439999999999998 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.329999999999998 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.430000000000007 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.200000000000003 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.557 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 62.420000000000002 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.675 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.3 OUTLIER -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.129999999999995 110.928 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 74.25 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.430000000000007 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.675 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.119999999999997 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.140000000000001 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' HD13 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.109999999999999 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.441 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 75.010000000000005 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.299999999999997 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.219999999999999 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.329999999999998 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.129999999999995 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.329999999999998 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 74.209999999999994 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.299999999999997 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.310000000000002 110.911 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.430000000000007 110.915 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.409999999999997 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.518 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.409999999999997 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.530000000000001 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.450000000000003 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 70.109999999999999 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 74.129999999999995 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 74.420000000000002 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.52 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 75.209999999999994 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.475 ' O ' ' CG2' ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.519999999999996 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 60.340000000000003 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 72.319999999999993 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.575 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 73.530000000000001 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.475 ' CG2' ' O ' ' A' ' 44' ' ' VAL . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.409999999999997 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' CB ' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.329999999999998 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 75.109999999999999 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.209999999999994 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 73.5 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 73.019999999999996 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.130000000000003 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.129999999999995 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.432 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 73.519999999999996 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.510000000000005 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.209999999999994 110.909 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.921 0.391 . . . . 72.450000000000003 111.057 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.430000000000007 111.101 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.120000000000005 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.456 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.099999999999994 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 54.340000000000003 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.574 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.340000000000003 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.310000000000002 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.573 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.030000000000001 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 74.340000000000003 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.426 ' O ' ' C ' ' A' ' 19' ' ' GLN . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.409999999999997 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 74.530000000000001 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.150000000000006 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 22' ' ' GLN . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 73.150000000000006 110.886 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.4 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.109999999999999 110.869 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.423 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.239999999999995 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.949 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.472 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 73.109999999999999 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.109999999999999 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.456 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.209999999999994 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 32' ' ' LEU . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.430000000000007 110.856 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.467 HD11 ' CG2' ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 74.530000000000001 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.812 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.519999999999996 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 75.109999999999999 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.477 ' CE3' HD13 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.430000000000007 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 74.450000000000003 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 73.420000000000002 110.87 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 47' ' ' SER . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 75.0 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' MET . . . . . 0.445 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.120000000000005 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.140000000000001 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.445 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 72.549999999999997 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.467 ' CG2' HD11 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 70.519999999999996 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.340000000000003 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.576 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 73.109999999999999 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 72.120000000000005 111.093 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.447 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.409999999999997 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 72.120000000000005 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.329999999999998 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.573 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.465 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.209999999999994 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.329999999999998 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 75.450000000000003 110.873 -179.932 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 34' ' ' LEU . 24.9 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.911 0.386 . . . . 74.129999999999995 111.098 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.475 HG23 ' CG2' ' A' ' 59' ' ' VAL . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 73.319999999999993 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.310000000000002 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 62.140000000000001 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.418 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 74.010000000000005 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.310000000000002 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 70.200000000000003 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.219999999999999 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.430000000000007 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.450000000000003 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 74.239999999999995 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.510000000000005 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 19' ' ' GLN . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.472 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 73.019999999999996 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.46 ' N ' HD11 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.099999999999994 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.464 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 75.540000000000006 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.464 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.409999999999997 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.409999999999997 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.430000000000007 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.319999999999993 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 74.120000000000005 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 75.019999999999996 110.955 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 8' ' ' VAL . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.409999999999997 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.833 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.329999999999998 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HB3' ' CD2' ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.140000000000001 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.409999999999997 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.549999999999997 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.030000000000001 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.417 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.310000000000002 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.439999999999998 111.086 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 75.310000000000002 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 71.219999999999999 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 62.200000000000003 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.319999999999993 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.540000000000006 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.299999999999997 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 72.109999999999999 111.15 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.472 ' HA3' ' CB ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 75.25 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.109999999999999 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 73.530000000000001 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.439999999999998 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.329999999999998 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.140000000000001 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.140000000000001 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.475 ' CG2' HG23 ' A' ' 10' ' ' VAL . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 71.329999999999998 111.176 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.451 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.467 ' N ' HG13 ' A' ' 10' ' ' VAL . 2.2 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.129999999999995 110.849 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.866 0.365 . . . . 71.400000000000006 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.119999999999997 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.467 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 72.25 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.477 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 75.430000000000007 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.349999999999994 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.558 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.558 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.439999999999998 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.510000000000005 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.329999999999998 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 75.140000000000001 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.432 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.230000000000004 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.3 mm-40 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 74.510000000000005 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 74.340000000000003 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.455 ' OE1' ' N ' ' A' ' 19' ' ' GLN . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 75.150000000000006 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.493 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 74.239999999999995 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.329999999999998 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.421 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.319999999999993 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.409999999999997 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.439999999999998 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.477 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.219999999999999 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.466 HD11 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.120000000000005 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.946 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.049999999999997 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.430000000000007 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 75.109999999999999 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.229999999999997 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.499 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.140000000000001 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.209999999999994 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.521 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.140000000000001 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 111.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.482 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.030000000000001 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.441 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 73.099999999999994 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.219999999999999 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 73.150000000000006 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.482 ' CA ' HD12 ' A' ' 24' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.140000000000001 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 72.209999999999994 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.521 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.329999999999998 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 72.409999999999997 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.499 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.120000000000005 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.329999999999998 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 74.150000000000006 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.467 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 64.439999999999998 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.407 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 74.329999999999998 110.837 -179.897 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.829 0.347 . . . . 74.430000000000007 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.140000000000001 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.474 HG23 ' CG2' ' A' ' 59' ' ' VAL . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 75.219999999999999 111.126 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 65.140000000000001 111.018 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.140000000000001 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.439999999999998 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.140000000000001 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.482 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 72.530000000000001 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.019999999999996 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.319999999999993 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.209999999999994 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.349999999999994 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.402 ' HA ' ' N ' ' A' ' 53' ' ' PHE . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.485 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 75.019999999999996 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.120000000000005 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.472 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 72.400000000000006 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.425 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 73.209999999999994 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.420000000000002 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.200000000000003 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.019999999999996 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 72.340000000000003 110.931 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.219999999999999 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.439999999999998 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.467 ' CD1' ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 74.530000000000001 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.464 ' CD1' HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB3' ' CD1' ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.310000000000002 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 62.109999999999999 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.120000000000005 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.239999999999995 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.513 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 75.510000000000005 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 75.109999999999999 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.425 ' O ' ' CG2' ' A' ' 51' ' ' THR . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.481 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 74.409999999999997 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.445 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.409999999999997 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 72.129999999999995 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.439999999999998 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.477 ' CA ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.485 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.240000000000002 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.441 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.439999999999998 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.340000000000003 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.430000000000007 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 74.230000000000004 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.319999999999993 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.230000000000004 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.474 ' CG2' HG23 ' A' ' 10' ' ' VAL . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.019999999999996 111.117 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.445 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.109999999999999 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.45 ' N ' HG11 ' A' ' 10' ' ' VAL . 8.7 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 71.349999999999994 110.901 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 54.200000000000003 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m -156.87 83.87 0.95 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.855 0.36 . . . . 73.010000000000005 110.893 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.3 m -77.2 115.55 17.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 73.209999999999994 111.138 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm 67.79 148.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.888 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.74 82.33 5.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 73.040000000000006 111.095 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -156.76 90.9 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.297 -0.411 . . . . 74.5 110.855 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -140.3 38.45 1.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.400000000000006 110.844 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.417 ' CG1' HD23 ' A' ' 34' ' ' LEU . 32.4 t -149.12 125.27 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 75.420000000000002 111.115 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG23 ' N ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 111.087 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.461 ' N ' HG23 ' A' ' 9' ' ' VAL . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 74.040000000000006 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.439999999999998 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.129999999999995 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.430000000000007 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.299999999999997 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 74.209999999999994 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.329999999999998 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.329999999999998 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.299999999999997 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.519999999999996 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 63.240000000000002 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.329999999999998 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.140000000000001 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.887 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 74.319999999999993 110.886 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.409999999999997 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 74.450000000000003 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.519999999999996 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.129999999999995 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.239999999999995 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 75.109999999999999 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 74.439999999999998 110.958 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.310000000000002 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.417 HD23 ' CG1' ' A' ' 8' ' ' VAL . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.401 ' CD1' HG22 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 74.219999999999999 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 75.209999999999994 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.415 ' CG ' HD22 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.409999999999997 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.219999999999999 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 72.140000000000001 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.519999999999996 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.340000000000003 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.457 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 75.329999999999998 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.420000000000002 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 74.140000000000001 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.310000000000002 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.349999999999994 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.040000000000006 110.828 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.219999999999999 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.109999999999999 110.93 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.401 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 71.329999999999998 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 71.019999999999996 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 74.329999999999998 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.439999999999998 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.049999999999997 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 72.329999999999998 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.329999999999998 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.402 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 73.510000000000005 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.409999999999997 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -63.18 142.48 58.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.510000000000005 110.825 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' CB ' ' A' ' 63' ' ' ASN . 0.1 OUTLIER -109.4 -166.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.493 . . . . 74.310000000000002 110.889 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.445 ' CB ' ' O ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER 79.04 25.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 73.329999999999998 110.924 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 61.3 p -62.32 173.73 1.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 74.239999999999995 110.888 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.25 -157.04 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.099999999999994 111.079 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -45.35 142.6 2.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.329999999999998 110.844 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.26 76.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 72.420000000000002 111.034 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.33 -58.23 8.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.540000000000006 111.081 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.82 120.76 26.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 61.310000000000002 111.105 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 71' ' ' SER . 6.7 p-10 -123.82 84.9 2.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 74.230000000000004 110.93 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 70' ' ' ASN . 1.8 t 35.47 83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.299999999999997 110.889 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 70.420000000000002 110.889 -179.735 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.495 -0.242 . . . . 51.43 112.495 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.17 132.38 45.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.419 . . . . 62.530000000000001 110.84 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -91.25 163.3 14.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 73.530000000000001 111.176 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.3 mtm -84.73 138.1 32.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.278 -0.419 . . . . 75.209999999999994 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.79 176.78 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 74.0 111.092 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 57.29 106.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 62.439999999999998 110.857 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -123.96 85.21 2.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 71.329999999999998 110.844 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t -108.78 146.22 14.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 72.25 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 73.519999999999996 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG1' HD11 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.129999999999995 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.451 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 75.409999999999997 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 64.239999999999995 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.452 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.439999999999998 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.452 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.150000000000006 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.510000000000005 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.508 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.530000000000001 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.508 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 72.099999999999994 110.907 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.010000000000005 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.019999999999996 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.099999999999994 110.869 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.150000000000006 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 74.109999999999999 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.454 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.109999999999999 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 74.510000000000005 110.923 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 71.140000000000001 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 71.209999999999994 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.450000000000003 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 72.409999999999997 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.299999999999997 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.54 HD12 ' CE3' ' A' ' 42' ' ' TRP . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.209999999999994 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.463 ' N ' HD21 ' A' ' 34' ' ' LEU . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.430000000000007 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.299999999999997 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.518 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.520000000000003 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.030000000000001 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.454 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 74.109999999999999 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.209999999999994 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 74.010000000000005 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.54 ' CE3' HD12 ' A' ' 34' ' ' LEU . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.140000000000001 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.476 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.030000000000001 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.510000000000005 111.148 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.140000000000001 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 74.140000000000001 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 62.530000000000001 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.420000000000002 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.446 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.310000000000002 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 74.030000000000001 112.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 75.530000000000001 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 75.209999999999994 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 75.439999999999998 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 72.109999999999999 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.540000000000006 111.14 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.230000000000004 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -67.03 143.83 56.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 74.510000000000005 110.837 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.15 162.06 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 72.120000000000005 110.961 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -136.15 35.1 2.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 74.420000000000002 110.87 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -58.9 85.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 64.340000000000003 110.872 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.9 88.15 2.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 72.219999999999999 111.054 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 60.92 128.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.040000000000006 110.917 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.65 -50.66 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 75.450000000000003 111.065 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.5 -43.27 62.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 73.019999999999996 111.093 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -99.95 94.12 6.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.437 . . . . 63.140000000000001 111.15 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.442 ' O ' ' CG ' ' A' ' 70' ' ' ASN . 0.7 OUTLIER -178.7 117.87 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 74.120000000000005 110.898 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 p 59.85 120.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.140000000000001 110.847 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 72.150000000000006 110.863 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.555 -0.218 . . . . 75.439999999999998 112.555 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m 39.57 50.97 2.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 74.329999999999998 110.82 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.8 m -53.58 114.87 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 71.239999999999995 111.114 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.6 ttt -125.12 177.59 6.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.168 -0.469 . . . . 73.019999999999996 110.882 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.94 177.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 64.549999999999997 111.142 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -101.4 112.11 24.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 61.32 110.871 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -104.71 -175.86 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 74.519999999999996 110.875 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -116.56 142.65 29.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.510000000000005 111.135 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 74.209999999999994 111.133 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.46 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.329999999999998 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.459 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 74.129999999999995 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.458 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.430000000000007 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.458 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.129999999999995 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.530000000000001 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.503 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.010000000000005 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 74.109999999999999 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.503 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.040000000000006 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.109999999999999 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.409999999999997 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 74.450000000000003 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.109999999999999 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 73.329999999999998 110.816 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.45 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 73.299999999999997 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.439999999999998 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.310000000000002 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.404 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 73.450000000000003 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 75.230000000000004 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.409999999999997 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 74.409999999999997 110.843 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 62.229999999999997 110.878 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.468 ' CD1' HG22 ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.310000000000002 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.219999999999999 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.430000000000007 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.340000000000003 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.415 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.200000000000003 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.43 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.019999999999996 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.140000000000001 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 70.140000000000001 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.230000000000004 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 73.200000000000003 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.510000000000005 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.140000000000001 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.230000000000004 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.404 ' C ' HG12 ' A' ' 54' ' ' VAL . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.329999999999998 110.873 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.404 HG12 ' C ' ' A' ' 53' ' ' PHE . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 72.25 111.163 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.415 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.520000000000003 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 74.540000000000006 110.895 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.400000000000006 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.468 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 73.319999999999993 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.46 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 74.510000000000005 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -63.34 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 75.439999999999998 110.882 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.1 165.2 0.52 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 75.319999999999993 110.918 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -171.45 38.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.868 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 23.6 m -74.34 85.07 1.95 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 73.530000000000001 110.837 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.4 77.44 7.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.540000000000006 111.131 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.06 120.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 74.310000000000002 110.887 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.11 62.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 74.439999999999998 111.122 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -83.66 35.55 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 72.310000000000002 111.131 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.02 -48.04 11.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 74.430000000000007 111.126 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -110.76 177.35 4.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 73.430000000000007 110.893 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 72' ' ' SER . 3.9 m -76.43 80.96 3.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 71.319999999999993 110.924 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.404 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 72.010000000000005 110.919 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.474 -0.25 . . . . 75.049999999999997 112.474 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.94 96.93 4.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.936 0.398 . . . . 62.130000000000003 110.858 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.0 m -38.04 -61.7 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 64.230000000000004 111.165 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt 67.75 136.68 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 72.319999999999993 110.896 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.49 129.87 43.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.3 -0.409 . . . . 74.099999999999994 111.12 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 64.2 161.33 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 73.519999999999996 110.884 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -168.21 129.38 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 62.149999999999999 110.943 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.466 ' CG1' HD21 ' A' ' 34' ' ' LEU . 61.8 t -133.21 149.03 31.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 65.200000000000003 111.131 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.230000000000004 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.409 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 70.209999999999994 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.474 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 74.420000000000002 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 64.510000000000005 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.503 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 73.010000000000005 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.503 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.010000000000005 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.450000000000003 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.539 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.040000000000006 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 73.140000000000001 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.129999999999995 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.349999999999994 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 70.120000000000005 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.439999999999998 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.420000000000002 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.540000000000006 110.94 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.454 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 73.329999999999998 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 65.120000000000005 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.219999999999999 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 73.430000000000007 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD21 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.219999999999999 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 75.129999999999995 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.466 HD21 ' CG1' ' A' ' 8' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.449 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.340000000000003 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 71.219999999999999 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 74.519999999999996 110.824 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.299999999999997 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.239999999999995 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.450000000000003 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.400000000000006 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.340000000000003 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.505 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 73.5 111.157 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.43 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.849 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.432 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 74.439999999999998 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 72.329999999999998 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.432 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 72.150000000000006 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.449 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 74.0 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 51.409999999999997 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.505 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.519999999999996 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.419 HG12 ' C ' ' A' ' 53' ' ' PHE . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 73.340000000000003 111.148 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.520000000000003 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.230000000000004 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.539 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.239999999999995 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.409 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 64.299999999999997 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.040000000000006 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.99 140.41 56.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.109999999999999 110.845 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 168.42 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 74.409999999999997 110.896 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.425 ' CG ' ' O ' ' A' ' 63' ' ' ASN . 22.6 t30 -89.61 45.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.22 -0.445 . . . . 73.340000000000003 110.902 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.8 p -88.31 48.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 74.120000000000005 110.851 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.25 42.79 1.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 65.409999999999997 111.095 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -88.9 133.54 34.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 74.530000000000001 110.869 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.57 -40.8 12.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 72.549999999999997 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.43 -55.03 17.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 72.329999999999998 111.115 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.66 96.41 8.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.540000000000006 111.179 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 67.24 166.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.243 -0.435 . . . . 75.409999999999997 110.849 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.0 m 51.91 91.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 73.129999999999995 110.872 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 91.6 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 71.430000000000007 110.838 -179.806 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.472 -0.251 . . . . 74.239999999999995 112.472 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.62 130.05 53.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.94 0.4 . . . . 74.040000000000006 110.85 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 m -73.92 108.17 6.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 75.299999999999997 111.152 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm -168.76 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 72.430000000000007 110.936 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.8 95.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 63.240000000000002 111.095 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 65.28 136.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 73.340000000000003 110.85 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -93.51 137.93 32.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.063 -0.517 . . . . 73.150000000000006 110.856 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t -120.85 145.88 26.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 74.129999999999995 111.106 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.239999999999995 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.466 ' CG1' HD11 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 71.120000000000005 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 74.329999999999998 111.146 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.239999999999995 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 73.420000000000002 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.200000000000003 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.420000000000002 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.527 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 75.310000000000002 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.527 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.430000000000007 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.834 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 74.310000000000002 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.150000000000006 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.510000000000005 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.91 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.834 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.329999999999998 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.402 HD11 ' N ' ' A' ' 52' ' ' GLY . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.549999999999997 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.040000000000006 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.453 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.450000000000003 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.401 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 74.109999999999999 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 74.140000000000001 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.230000000000004 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.539999999999999 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.422 ' C ' HD23 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.467 HD23 ' N ' ' A' ' 32' ' ' LEU . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 70.230000000000004 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 71.129999999999995 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.54 HD12 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 64.120000000000005 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.468 ' N ' HD21 ' A' ' 34' ' ' LEU . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 73.109999999999999 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.219999999999999 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 110.824 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.140000000000001 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.140000000000001 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.299999999999997 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 72.239999999999995 110.937 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.54 ' CE3' HD12 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.120000000000005 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.140000000000001 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 73.310000000000002 111.165 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 64.319999999999993 110.85 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.010000000000005 110.942 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.400000000000006 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.239999999999995 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.552 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.219999999999999 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.150000000000006 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.431 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.120000000000005 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.402 ' N ' HD11 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.299999999999997 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.319999999999993 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.150000000000006 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.209999999999994 112.365 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.420000000000002 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.109999999999999 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.409 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.149999999999999 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.030000000000001 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.46 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 84.0 mtt180 -50.62 144.01 8.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 72.219999999999999 110.903 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 tttm -52.0 -68.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 74.430000000000007 110.863 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.46 ' ND2' ' O ' ' A' ' 61' ' ' ARG . 12.9 p30 38.6 69.5 0.26 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 75.319999999999993 110.933 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.5 t -79.29 -61.17 2.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 65.299999999999997 110.852 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.7 97.77 9.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 111.076 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 53.04 100.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 110.839 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.74 33.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 74.209999999999994 111.104 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.77 36.13 0.85 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.223 -0.444 . . . . 61.140000000000001 111.082 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.64 92.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 71.420000000000002 111.081 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 71' ' ' SER . 25.0 m-80 -152.81 -47.3 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 74.420000000000002 110.883 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER 34.72 88.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 72.400000000000006 110.835 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 60.399999999999999 110.874 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.471 -0.252 . . . . 73.340000000000003 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 t -120.15 86.48 2.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 73.329999999999998 110.817 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.2 m -82.53 145.86 29.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 111.179 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtm -144.72 -61.68 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 74.099999999999994 110.83 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.01 99.74 6.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 111.119 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -151.89 91.11 1.59 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 74.530000000000001 110.911 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -114.69 137.45 51.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 75.450000000000003 110.836 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.464 HG12 ' CD2' ' A' ' 34' ' ' LEU . 70.1 t -124.72 141.84 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 74.239999999999995 111.154 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.510000000000005 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.466 HG22 ' CG2' ' A' ' 59' ' ' VAL . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.299999999999997 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.099999999999994 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.349999999999994 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.519999999999996 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 73.540000000000006 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.549999999999997 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.109999999999999 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 74.530000000000001 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 74.340000000000003 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.010000000000005 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 74.030000000000001 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 65.209999999999994 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 73.019999999999996 110.89 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 110.96 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.319999999999993 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.436 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.540000000000006 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.450000000000003 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.340000000000003 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 73.450000000000003 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.109999999999999 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.450000000000003 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.420000000000002 110.918 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.540000000000006 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.464 ' CD2' HG12 ' A' ' 8' ' ' VAL . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.415 ' CD1' HG22 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 74.439999999999998 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.510000000000005 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.426 ' CG ' HD23 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.310000000000002 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.099999999999994 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 71.349999999999994 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.420000000000002 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.409999999999997 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 75.150000000000006 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.524 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.41 ' O ' ' CG2' ' A' ' 51' ' ' THR . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.129999999999995 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.219999999999999 110.869 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 74.209999999999994 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.310000000000002 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.099999999999994 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.415 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.430000000000007 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.524 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.109999999999999 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.430000000000007 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.400000000000006 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.310000000000002 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 72.329999999999998 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.450000000000003 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.466 ' CG2' HG22 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.510000000000005 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.429 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HG2' ' CG1' ' A' ' 8' ' ' VAL . 27.2 mtm105 -50.28 142.39 10.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.150000000000006 110.888 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.54 166.31 0.31 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 72.439999999999998 110.861 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -46.74 -23.76 0.47 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 72.099999999999994 110.921 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.5 p -87.95 123.23 32.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 74.349999999999994 110.833 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -110.79 113.27 25.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.16 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 59.82 121.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.189 -0.46 . . . . 73.400000000000006 110.905 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.14 -15.22 59.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 72.420000000000002 111.119 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -108.45 35.73 3.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.225 -0.443 . . . . 75.150000000000006 111.04 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -36.72 10.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 71.109999999999999 111.083 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.1 -53.7 53.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 61.420000000000002 110.973 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.55 127.53 7.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 74.219999999999999 110.833 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 73.519999999999996 110.837 -179.762 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.496 -0.242 . . . . 74.409999999999997 112.496 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 m -98.93 102.19 13.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 61.5 110.891 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.9 m -54.82 127.32 27.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 74.209999999999994 111.184 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -67.36 147.07 53.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 74.109999999999999 110.885 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.99 178.96 3.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 72.209999999999994 111.078 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -84.11 100.24 11.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.420000000000002 110.883 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.53 176.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 71.25 110.881 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.78 143.1 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 65.25 111.154 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.549999999999997 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 72.099999999999994 111.127 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.408 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 75.420000000000002 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 70.209999999999994 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.049999999999997 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.450000000000003 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.52 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 75.140000000000001 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.439999999999998 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 74.140000000000001 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.655 ' CB ' ' HE2' ' A' ' 23' ' ' GLU . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.549999999999997 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.109999999999999 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.239999999999995 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.150000000000006 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.655 ' HE2' ' CB ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 74.109999999999999 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 74.040000000000006 110.91 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 73.239999999999995 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.461 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.401 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 75.239999999999995 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 74.310000000000002 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.099999999999994 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.129999999999995 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.408 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 73.510000000000005 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.467 ' CD1' ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 72.120000000000005 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.404 HD23 ' CG ' ' A' ' 37' ' ' ASP . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.406 ' CD1' HG23 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 75.120000000000005 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 74.219999999999999 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.404 ' CG ' HD23 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.219999999999999 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 74.299999999999997 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 72.129999999999995 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 73.129999999999995 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.416 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 72.219999999999999 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 70.409999999999997 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.219999999999999 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 65.040000000000006 111.083 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.467 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 73.540000000000006 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.420000000000002 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.400000000000006 110.852 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.561 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.349999999999994 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.897 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.406 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.340000000000003 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.109999999999999 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 74.239999999999995 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.030000000000001 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.416 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 70.540000000000006 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 73.299999999999997 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 71.319999999999993 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.030000000000001 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.319999999999993 111.192 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -64.89 141.33 58.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 63.119999999999997 110.907 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -56.2 143.12 34.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.22 -0.445 . . . . 72.340000000000003 110.908 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -101.38 -18.43 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 64.439999999999998 110.848 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -84.12 83.78 7.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 65.040000000000006 110.902 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -111.01 97.26 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.179 -0.464 . . . . 74.439999999999998 111.091 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.5 mtt180 -63.39 131.9 49.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 74.310000000000002 110.906 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.06 -50.76 64.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 71.430000000000007 111.155 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.84 -48.88 72.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.540000000000006 111.099 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.27 107.34 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 73.049999999999997 111.084 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.43 115.17 29.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 73.040000000000006 110.91 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.54 96.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 73.129999999999995 110.825 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 73.400000000000006 110.91 -179.877 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.47 -0.252 . . . . 73.430000000000007 112.47 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -49.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 70.530000000000001 110.876 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 93.9 m -59.65 137.09 58.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 75.140000000000001 111.141 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mtm -120.67 156.96 30.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.256 -0.429 . . . . 74.420000000000002 110.895 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.52 144.88 25.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 74.5 111.12 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.46 104.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 70.409999999999997 110.844 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -131.16 -178.89 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 75.140000000000001 110.896 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.439 ' CG1' HD23 ' A' ' 34' ' ' LEU . 94.8 t -133.87 147.2 30.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 72.319999999999993 111.076 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.319999999999993 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.425 ' HB ' ' C ' ' A' ' 60' ' ' GLU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.329999999999998 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.464 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 75.549999999999997 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.099999999999994 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.478 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.420000000000002 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.478 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.409999999999997 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.120000000000005 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.531 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 74.109999999999999 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.329999999999998 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.200000000000003 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 75.109999999999999 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.329999999999998 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.239999999999995 110.956 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.891 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.452 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 72.349999999999994 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.200000000000003 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 75.439999999999998 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 74.329999999999998 110.876 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.310000000000002 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.42 ' CD2' ' N ' ' A' ' 32' ' ' LEU . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 75.219999999999999 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.019999999999996 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.439 HD23 ' CG1' ' A' ' 8' ' ' VAL . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.519999999999996 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.423 HD12 ' CG2' ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.420000000000002 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.209999999999994 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.464 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.129999999999995 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.319999999999993 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 74.030000000000001 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.497 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.319999999999993 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.464 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.439999999999998 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.420000000000002 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.41 ' O ' ' CG2' ' A' ' 51' ' ' THR . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 74.5 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.912 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 63.520000000000003 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 55.32 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.466 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.200000000000003 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 54.219999999999999 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.466 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 75.030000000000001 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.423 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.239999999999995 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.140000000000001 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.299999999999997 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.140000000000001 111.126 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.497 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.119999999999997 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.340000000000003 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 73.109999999999999 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 75.299999999999997 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 72.439999999999998 111.167 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.425 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.549999999999997 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.9 ptm180 -61.38 143.4 55.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 74.439999999999998 110.864 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.35 164.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 75.329999999999998 110.923 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -130.28 -30.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 63.43 110.851 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -85.24 92.41 8.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 70.230000000000004 110.81 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.29 100.93 12.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 111.101 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -79.25 165.63 23.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 74.099999999999994 110.882 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.74 -48.76 11.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 63.409999999999997 111.082 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -90.04 36.72 0.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 74.450000000000003 111.027 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -98.27 33.98 2.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 74.540000000000006 111.114 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -98.62 163.57 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 74.439999999999998 110.937 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.4 81.8 2.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 75.430000000000007 110.857 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.119 -0.491 . . . . 74.230000000000004 110.849 -179.798 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.463 -0.255 . . . . 63.119999999999997 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -155.63 -48.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.922 0.392 . . . . 75.420000000000002 110.876 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.3 m -59.54 117.77 5.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 73.319999999999993 111.102 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.2 mtm 62.71 131.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 75.150000000000006 110.92 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.3 170.26 14.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.24 -0.436 . . . . 75.299999999999997 111.121 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -139.83 132.0 28.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 74.409999999999997 110.896 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -133.95 159.91 39.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.0 110.833 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t -131.3 140.63 47.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 74.439999999999998 111.096 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 111.115 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.468 ' CG1' HD13 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 72.549999999999997 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.485 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 111.042 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.409999999999997 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.439999999999998 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.219999999999999 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.517 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.420000000000002 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 70.120000000000005 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.422 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.350000000000001 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.638 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.319999999999993 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.439999999999998 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.540000000000006 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.638 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.210000000000001 110.944 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 52' ' ' GLY . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.310000000000002 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.451 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 72.349999999999994 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 73.140000000000001 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.219999999999999 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 74.430000000000007 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 54.149999999999999 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 74.430000000000007 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.466 ' N ' HD21 ' A' ' 32' ' ' LEU . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.299999999999997 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.528 HD11 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.010000000000005 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.408 ' N ' HD22 ' A' ' 34' ' ' LEU . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 72.209999999999994 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.496 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.210000000000001 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 73.439999999999998 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.400000000000006 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 71.25 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.487 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 74.329999999999998 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE3' HD11 ' A' ' 34' ' ' LEU . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.140000000000001 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.529 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.540000000000006 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.510000000000005 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.040000000000006 110.86 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.929 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.439999999999998 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.209999999999994 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.120000000000005 111.158 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.467 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.340000000000003 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.529 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 74.219999999999999 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.423 HG13 ' C ' ' A' ' 53' ' ' PHE . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.120000000000005 111.112 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.49 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.329999999999998 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.229999999999997 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.299999999999997 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.517 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 61.140000000000001 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 72.5 111.118 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -64.22 136.44 57.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.319999999999993 110.872 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -55.06 130.29 41.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.430000000000007 110.856 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -94.97 37.26 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 74.540000000000006 110.936 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.6 t -70.46 174.39 5.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 75.409999999999997 110.929 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 89.53 1.5 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 74.230000000000004 111.093 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 61.08 130.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 70.400000000000006 110.919 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.46 -26.14 35.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 74.400000000000006 111.122 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.49 32.3 1.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 75.540000000000006 111.095 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -105.04 78.49 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 75.040000000000006 111.087 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -144.11 -37.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 72.129999999999995 110.884 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m 55.51 167.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 72.340000000000003 110.878 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.310000000000002 110.885 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.471 -0.252 . . . . 73.319999999999993 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -129.08 78.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.902 0.382 . . . . 62.450000000000003 110.834 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.3 m -73.07 122.82 22.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.25 111.212 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.1 mtt -145.19 153.74 41.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 73.219999999999999 110.925 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -82.68 -47.63 11.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 62.149999999999999 111.164 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -102.5 94.28 5.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 72.439999999999998 110.908 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -123.91 95.0 4.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.461 . . . . 73.219999999999999 110.858 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 42.3 t -108.43 145.47 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.468 . . . . 74.129999999999995 111.108 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.530000000000001 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.462 HG22 ' CG2' ' A' ' 59' ' ' VAL . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.010000000000005 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 64.239999999999995 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.219999999999999 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.536 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 73.349999999999994 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.400000000000006 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 70.200000000000003 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.482 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 72.510000000000005 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 71.310000000000002 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.240000000000002 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 73.200000000000003 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.530000000000001 110.904 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.230000000000004 110.969 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 52.329999999999998 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 72.329999999999998 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.412 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.239999999999995 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.230000000000004 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.310000000000002 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.412 ' C ' HD21 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.412 HD21 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 73.140000000000001 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.219999999999999 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 ' N ' ' O ' ' A' ' 8' ' ' VAL . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.409999999999997 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.467 ' CD1' HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.420000000000002 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.409999999999997 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.422 ' OD2' ' CD2' ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 73.329999999999998 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.129999999999995 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 75.140000000000001 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.310000000000002 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.413 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.120000000000005 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.019999999999996 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.030000000000001 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 75.319999999999993 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.420000000000002 110.873 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.299999999999997 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.219999999999999 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.299999999999997 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.56 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.340000000000003 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.467 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 73.450000000000003 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 74.319999999999993 112.501 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 74.239999999999995 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 73.150000000000006 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 73.120000000000005 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 65.329999999999998 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.409999999999997 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.409999999999997 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.462 ' CG2' HG22 ' A' ' 10' ' ' VAL . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.209999999999994 111.118 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.418 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.010000000000005 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' N ' HG11 ' A' ' 10' ' ' VAL . 74.3 mtt180 -49.88 133.81 21.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.82 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -46.84 -78.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 74.109999999999999 110.889 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -146.6 39.74 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 64.349999999999994 110.911 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 64.0 m -86.04 -37.84 18.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 74.239999999999995 110.875 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -88.24 101.73 14.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.019999999999996 111.071 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 58.53 100.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.140000000000001 110.901 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.3 -32.81 39.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 75.510000000000005 111.091 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.05 -63.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 62.420000000000002 111.118 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.78 96.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 74.230000000000004 111.109 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.05 173.77 9.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 73.340000000000003 110.826 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.92 170.25 2.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.468 . . . . 72.439999999999998 110.924 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 74.540000000000006 110.839 -179.767 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.479 -0.248 . . . . 61.530000000000001 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.16 44.98 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 72.420000000000002 110.826 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.0 m -64.98 130.17 42.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 63.140000000000001 111.189 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.34 156.37 15.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 72.25 110.835 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.36 -60.82 2.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 53.329999999999998 111.096 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 44.14 40.68 3.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 74.340000000000003 110.859 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -94.88 150.52 20.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 75.239999999999995 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t -134.9 142.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 74.450000000000003 111.128 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.403 ' C ' HG13 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.510000000000005 111.127 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.449 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 64.439999999999998 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.45 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.400000000000006 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.129999999999995 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 71.530000000000001 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 73.540000000000006 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.539999999999999 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.239999999999995 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 74.540000000000006 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' HB2' ' C ' ' A' ' 23' ' ' GLU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.140000000000001 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.420000000000002 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.430000000000007 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 73.420000000000002 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.42 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.430000000000007 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.456 ' CD1' ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.239999999999995 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.329999999999998 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.409999999999997 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 74.109999999999999 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.319999999999993 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 72.430000000000007 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.420000000000002 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.461 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.430000000000007 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.411 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.420000000000002 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 74.409999999999997 110.951 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.469 ' CD1' HG23 ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 71.450000000000003 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 63.399999999999999 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 73.239999999999995 110.87 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 64.209999999999994 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.129999999999995 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.4 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.319999999999993 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.420000000000002 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.475 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 74.430000000000007 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.219999999999999 111.094 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.129999999999995 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.310000000000002 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.519999999999996 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.577 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 75.349999999999994 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.469 HG23 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 74.099999999999994 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 74.439999999999998 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 73.430000000000007 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 65.150000000000006 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.4 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.099999999999994 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.409999999999997 110.883 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.519999999999996 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 73.519999999999996 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.449 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.349999999999994 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.200000000000003 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -56.29 144.07 31.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.310000000000002 110.937 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -48.98 -73.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.239999999999995 110.896 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 48.53 61.65 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 62.030000000000001 110.859 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 71.9 m -65.2 167.53 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 74.099999999999994 110.868 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.09 97.22 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 73.530000000000001 111.133 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -137.51 133.44 34.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 74.329999999999998 110.842 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.7 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 75.299999999999997 111.12 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -97.06 26.63 4.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 62.350000000000001 111.079 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.09 156.94 23.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 73.319999999999993 111.079 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -142.76 172.38 12.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 73.230000000000004 110.936 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 72' ' ' SER . 0.1 OUTLIER 61.09 84.37 0.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 75.420000000000002 110.868 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.831 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.484 -0.246 . . . . 72.209999999999994 112.484 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p 172.65 -31.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 74.010000000000005 110.764 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -74.72 138.56 42.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 64.109999999999999 111.177 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mtt -149.36 171.08 17.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 75.530000000000001 110.862 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.65 177.82 4.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 64.219999999999999 111.088 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -45.47 104.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 73.450000000000003 110.903 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -126.58 151.4 47.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 70.040000000000006 110.83 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t -118.97 147.29 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.515 . . . . 74.340000000000003 111.082 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.412 ' C ' HG11 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.140000000000001 111.132 179.897 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 70.319999999999993 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.434 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.120000000000005 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.020000000000003 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 75.120000000000005 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.57 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.420000000000002 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.219999999999999 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 74.530000000000001 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.419 ' O ' ' C ' ' A' ' 19' ' ' GLN . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.420000000000002 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.120000000000005 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.099999999999994 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.409 ' C ' ' HA3' ' A' ' 52' ' ' GLY . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.400000000000006 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.484 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.209999999999994 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.239999999999995 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 75.329999999999998 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 71.219999999999999 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.219999999999999 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 74.420000000000002 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.434 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 71.230000000000004 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.47 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.040000000000006 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.400000000000006 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.465 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 72.230000000000004 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.457 HD12 ' CG2' ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 73.129999999999995 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 75.140000000000001 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.049999999999997 110.929 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.230000000000004 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.455 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 65.209999999999994 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.140000000000001 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.230000000000004 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.41 ' CE3' HD13 ' A' ' 34' ' ' LEU . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 75.340000000000003 110.905 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.536 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.140000000000001 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' CG2' ' A' ' 51' ' ' THR . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.129999999999995 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.109999999999999 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.459 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.439999999999998 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.129999999999995 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.546 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.329999999999998 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.109999999999999 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.474 ' CA ' HD11 ' A' ' 24' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.420000000000002 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.484 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.130000000000003 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.536 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 64.140000000000001 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.340000000000003 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.200000000000003 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 61.409999999999997 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 75.219999999999999 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 71.439999999999998 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 75.230000000000004 110.945 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.79 143.53 30.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 75.219999999999999 110.932 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -45.02 -93.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 73.150000000000006 110.92 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.481 ' O ' ' N ' ' A' ' 65' ' ' ALA . 4.3 p-10 -116.39 8.13 14.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.451 . . . . 73.430000000000007 110.927 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.8 m -55.67 82.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.310000000000002 110.915 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 63' ' ' ASN . . . -102.15 107.68 18.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.349999999999994 111.17 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -91.97 131.87 36.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 71.349999999999994 110.92 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.08 89.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 72.540000000000006 111.159 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.08 -59.28 3.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 62.130000000000003 111.068 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.97 107.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 71.120000000000005 111.098 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -150.72 162.25 41.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.130000000000003 110.883 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 m -128.09 170.55 12.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 73.230000000000004 110.839 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 72.340000000000003 110.899 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.436 -0.266 . . . . 74.340000000000003 112.436 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.94 86.95 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 62.32 110.88 -179.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.8 m -74.59 139.7 43.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 74.230000000000004 111.103 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -44.49 148.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 110.857 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.07 98.44 5.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 75.129999999999995 111.098 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -158.92 39.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 73.040000000000006 110.868 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -142.09 176.27 9.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 71.239999999999995 110.86 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.462 ' CG1' HD23 ' A' ' 34' ' ' LEU . 87.4 t -121.13 146.71 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.226 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 75.510000000000005 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.456 HG13 ' N ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.150000000000006 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.329999999999998 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 75.230000000000004 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.439999999999998 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 73.150000000000006 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.129999999999995 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.475 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 73.510000000000005 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 74.439999999999998 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.475 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.430000000000007 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 72.219999999999999 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.439999999999998 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.340000000000003 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.349999999999994 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 75.420000000000002 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.310000000000002 110.929 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.447 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 72.150000000000006 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.129999999999995 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 65.219999999999999 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.530000000000001 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.349999999999994 110.828 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.415 HD23 ' N ' ' A' ' 32' ' ' LEU . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 73.319999999999993 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 74.120000000000005 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.462 HD23 ' CG1' ' A' ' 8' ' ' VAL . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 75.140000000000001 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.447 ' CD1' HG22 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 75.299999999999997 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.439999999999998 110.843 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 52.329999999999998 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.409999999999997 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.439999999999998 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.413 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 75.209999999999994 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 74.549999999999997 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.434 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 73.140000000000001 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.430000000000007 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 72.140000000000001 110.86 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 73.519999999999996 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.565 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 72.0 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.447 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.239999999999995 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.549999999999997 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.109999999999999 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.415 HG11 ' C ' ' A' ' 53' ' ' PHE . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 74.519999999999996 111.105 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.329999999999998 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 72.439999999999998 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.453 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 73.530000000000001 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.456 ' CG2' HG23 ' A' ' 10' ' ' VAL . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.140000000000001 111.154 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.239999999999995 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.456 ' N ' HG13 ' A' ' 10' ' ' VAL . 8.7 mtm180 -49.92 143.28 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.049999999999997 110.86 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -42.22 159.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 72.25 110.929 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.14 -24.34 8.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 72.349999999999994 110.888 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.6 t -54.24 -42.49 69.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 71.310000000000002 110.846 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.83 97.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 62.420000000000002 111.14 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.9 mtt180 51.45 100.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 74.420000000000002 110.83 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.19 69.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 73.140000000000001 111.134 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.79 -37.74 44.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 55.229999999999997 111.093 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -43.77 124.86 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.450000000000003 111.134 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 70' ' ' ASN . 22.1 p-10 -45.06 94.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 75.209999999999994 110.879 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.4 OUTLIER -103.63 6.15 36.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.420000000000002 110.779 -179.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.14 -0.482 . . . . 75.310000000000002 110.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.357 0 N-CA-C 112.492 -0.243 . . . . 73.400000000000006 112.492 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.37 88.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.934 0.397 . . . . 71.439999999999998 110.853 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.7 m -74.01 144.19 45.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 75.430000000000007 111.149 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.0 mtt -77.23 -49.39 15.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 71.200000000000003 110.845 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.43 155.58 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 74.140000000000001 111.062 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 61.32 91.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 75.030000000000001 110.885 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -163.0 137.24 6.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 72.200000000000003 110.887 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.456 ' CG1' HD23 ' A' ' 34' ' ' LEU . 40.3 t -138.38 144.78 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 71.230000000000004 111.098 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 74.340000000000003 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 64.439999999999998 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.417 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.239999999999995 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.563 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.409999999999997 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.563 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 74.319999999999993 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.340000000000003 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.099999999999994 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 73.219999999999999 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.4 ' HB1' ' C ' ' A' ' 23' ' ' GLU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 64.420000000000002 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 74.340000000000003 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 65.420000000000002 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 75.430000000000007 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.4 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.540000000000006 110.871 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 75.019999999999996 110.895 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.310000000000002 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.467 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.120000000000005 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.430000000000007 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.430000000000007 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.430000000000007 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.417 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.299999999999997 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 72.25 110.923 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.530000000000001 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.456 HD23 ' CG1' ' A' ' 8' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.954 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.019999999999996 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.438 ' OD2' ' N ' ' A' ' 37' ' ' ASP . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 74.150000000000006 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.129999999999995 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.140000000000001 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.319999999999993 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.430000000000007 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.558 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.349999999999994 111.105 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.439999999999998 110.883 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.430000000000007 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.239999999999995 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 72.510000000000005 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 73.120000000000005 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 71.310000000000002 111.203 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.558 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.540000000000006 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.230000000000004 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.340000000000003 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.239999999999995 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 74.230000000000004 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.492 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.422 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.140000000000001 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.209999999999994 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.432 ' CZ ' ' O ' ' A' ' 62' ' ' LYS . 4.8 ptm180 -65.76 143.9 57.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 110.946 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' O ' ' CZ ' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -46.21 170.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 72.230000000000004 110.872 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -135.49 -33.92 0.86 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.510000000000005 110.905 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.9 m -76.22 83.67 3.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.120000000000005 110.854 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.09 81.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 73.400000000000006 111.028 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -144.81 157.74 44.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 75.200000000000003 110.861 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.4 79.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 54.149999999999999 111.117 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -52.92 -45.08 67.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 75.430000000000007 111.161 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -46.53 112.99 0.57 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 74.150000000000006 111.148 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.423 ' C ' ' OD1' ' A' ' 70' ' ' ASN . 28.5 t-20 -49.61 111.58 0.52 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 64.329999999999998 110.916 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 78.8 p -145.75 113.9 6.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 71.5 110.865 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 61.200000000000003 110.887 -179.788 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.42 -0.272 . . . . 74.409999999999997 112.42 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.4 m -112.48 84.85 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.914 0.388 . . . . 74.109999999999999 110.799 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' MET . 54.3 m -61.74 141.05 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 71.239999999999995 111.128 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.417 ' C ' ' O ' ' A' ' 3' ' ' THR . 5.7 mtm -37.06 153.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 75.420000000000002 110.928 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -71.08 -65.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 75.219999999999999 111.082 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 5' ' ' ALA . 22.2 tt0 36.39 50.94 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 73.409999999999997 110.866 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.08 -168.73 2.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 72.230000000000004 110.804 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 18.2 t -121.08 113.23 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.1 -0.5 . . . . 73.329999999999998 111.064 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.475 HG22 ' N ' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 73.430000000000007 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.475 ' N ' HG22 ' A' ' 9' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.540000000000006 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.403 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 62.109999999999999 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.230000000000004 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.150000000000006 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.109999999999999 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.319999999999993 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.230000000000004 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.1 mm-40 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.010000000000005 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 72.109999999999999 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 72.409999999999997 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.040000000000006 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.439 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.329999999999998 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.450000000000003 110.946 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.129999999999995 110.879 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.468 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.209999999999994 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.45 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 71.349999999999994 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.099999999999994 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.229999999999997 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 74.099999999999994 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.403 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.230000000000004 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.239999999999995 110.947 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.219999999999999 110.896 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.445 ' CD1' HG22 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.450000000000003 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.420000000000002 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 72.420000000000002 110.791 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 72.109999999999999 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 74.200000000000003 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.487 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.209999999999994 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 74.120000000000005 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.438 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.450000000000003 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 73.439999999999998 110.904 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.219999999999999 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.129999999999995 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.150000000000006 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.445 HG22 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.200000000000003 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 65.420000000000002 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 75.310000000000002 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.420000000000002 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.487 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.020000000000003 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 73.329999999999998 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 73.519999999999996 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 75.0 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.473 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 74.409999999999997 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.42 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 75.219999999999999 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -64.08 136.67 57.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.219999999999999 110.855 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 63' ' ' ASN . 3.4 ttpm? -60.55 -73.97 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 110.897 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' LYS . 0.5 OUTLIER 35.83 39.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 74.340000000000003 110.921 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.4 p -83.39 119.58 24.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 71.420000000000002 110.842 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.6 38.52 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 71.019999999999996 111.093 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.42 134.19 55.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 110.911 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -80.44 -33.19 37.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 63.43 111.039 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.81 -58.23 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 74.420000000000002 111.082 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.04 107.26 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 73.129999999999995 111.04 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.43 ' O ' ' C ' ' A' ' 71' ' ' SER . 38.4 p-10 -157.79 134.97 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 70.200000000000003 110.887 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.431 ' O ' ' C ' ' A' ' 72' ' ' SER . 68.5 p 35.24 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 72.219999999999999 110.823 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 71' ' ' SER . 35.0 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 73.409999999999997 110.87 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.443 -0.263 . . . . 71.409999999999997 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.28 -80.33 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 72.310000000000002 110.82 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.07 106.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.16 -0.473 . . . . 72.120000000000005 111.172 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttp -170.64 -42.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.237 -0.438 . . . . 74.420000000000002 110.904 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 131.92 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 72.530000000000001 111.087 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 93.44 4.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 75.329999999999998 110.836 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.37 176.67 7.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 74.209999999999994 110.901 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t -109.48 138.08 38.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 111.173 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 72.430000000000007 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.432 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.349999999999994 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 62.100000000000001 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.510000000000005 111.083 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.200000000000003 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.428 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.439999999999998 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.329999999999998 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.430000000000007 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.200000000000003 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.557 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 62.420000000000002 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.675 ' HB2' ' HE2' ' A' ' 23' ' ' GLU . 0.3 OUTLIER -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.129999999999995 110.928 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 74.25 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.430000000000007 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.675 ' HE2' ' HB2' ' A' ' 19' ' ' GLN . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.119999999999997 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.140000000000001 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' HD13 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.109999999999999 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.441 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 75.010000000000005 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.299999999999997 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.219999999999999 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.329999999999998 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.129999999999995 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' HD3' ' N ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.329999999999998 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 74.209999999999994 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.299999999999997 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.310000000000002 110.911 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.430000000000007 110.915 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.409999999999997 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.518 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.409999999999997 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.530000000000001 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.450000000000003 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 70.109999999999999 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 74.129999999999995 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 74.420000000000002 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.52 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 75.209999999999994 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.475 ' O ' ' CG2' ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.340000000000003 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.519999999999996 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 60.340000000000003 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 72.319999999999993 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.575 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.439999999999998 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 73.530000000000001 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.475 ' CG2' ' O ' ' A' ' 44' ' ' VAL . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.409999999999997 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' CB ' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.329999999999998 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.52 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 75.109999999999999 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.209999999999994 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 73.5 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 73.019999999999996 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.130000000000003 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.129999999999995 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.432 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 73.519999999999996 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.510000000000005 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.74 143.5 30.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.209999999999994 110.909 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -53.39 132.49 39.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 72.310000000000002 110.955 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -105.92 33.67 3.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 70.219999999999999 110.902 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 89.0 p -87.36 84.55 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 70.400000000000006 110.853 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.49 -156.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 75.230000000000004 111.084 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.5 ttt85 -50.75 141.74 12.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 73.239999999999995 110.858 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.53 -52.55 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.040000000000006 111.093 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.66 55.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 64.409999999999997 111.148 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.12 143.15 57.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 64.310000000000002 111.052 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 m120 60.39 118.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 74.439999999999998 110.908 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.29 164.16 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 64.120000000000005 110.858 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 71.109999999999999 110.878 -179.798 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 112.53 -0.228 . . . . 64.319999999999993 112.53 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.5 p -163.92 76.98 0.37 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.92 0.39 . . . . 75.25 110.855 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.48 179.18 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 70.140000000000001 111.144 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.7 153.59 43.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 75.430000000000007 110.92 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.71 92.09 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 71.120000000000005 111.157 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -137.84 82.34 1.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 64.040000000000006 110.92 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -142.88 157.0 45.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.069 -0.514 . . . . 74.239999999999995 110.891 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t -127.06 141.98 44.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 72.450000000000003 111.057 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.404 ' O ' ' N ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.430000000000007 111.101 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.465 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 71.120000000000005 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.456 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.099999999999994 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 54.340000000000003 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.574 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.574 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 75.340000000000003 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.310000000000002 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.573 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.030000000000001 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 74.340000000000003 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.426 ' O ' ' C ' ' A' ' 19' ' ' GLN . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 73.409999999999997 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 74.530000000000001 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.150000000000006 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 22' ' ' GLN . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 73.150000000000006 110.886 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.4 ' N ' ' HG2' ' A' ' 21' ' ' GLU . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.109999999999999 110.869 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.423 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.239999999999995 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.519999999999996 110.949 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.472 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.441 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 73.109999999999999 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.319999999999993 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.109999999999999 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.209999999999994 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.46 HD22 ' N ' ' A' ' 32' ' ' LEU . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.430000000000007 110.856 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 ' CE3' ' A' ' 42' ' ' TRP . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.467 HD11 ' CG2' ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 74.530000000000001 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.439999999999998 110.812 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.519999999999996 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 63.43 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.129999999999995 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 75.109999999999999 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.477 ' CE3' HD13 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.430000000000007 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.576 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 74.450000000000003 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 73.420000000000002 110.87 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 47' ' ' SER . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 75.0 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' MET . . . . . 0.445 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.120000000000005 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.140000000000001 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.445 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 72.549999999999997 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.467 ' CG2' HD11 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 70.519999999999996 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.340000000000003 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.576 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 73.109999999999999 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 72.120000000000005 111.093 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.447 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.409999999999997 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 72.120000000000005 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.329999999999998 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.573 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.340000000000003 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.465 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.209999999999994 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.329999999999998 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -52.77 144.16 14.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 75.450000000000003 110.873 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -106.55 151.4 25.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.409999999999997 110.904 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -99.47 31.56 3.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 72.409999999999997 110.93 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.3 t -70.53 -48.43 55.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 52.439999999999998 110.889 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.17 92.16 6.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.097 -0.501 . . . . 75.409999999999997 111.165 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -96.08 161.13 14.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 64.319999999999993 110.876 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.98 -50.05 64.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 70.319999999999993 111.17 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.77 36.11 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 64.329999999999998 111.148 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' C ' ' OD1' ' A' ' 70' ' ' ASN . . . -102.57 -46.58 4.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 72.400000000000006 111.1 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' A' ' 69' ' ' ALA . 3.1 m120 -150.3 -43.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.158 -0.474 . . . . 73.530000000000001 110.848 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 m -48.86 155.57 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 64.409999999999997 110.866 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 74.209999999999994 110.826 -179.797 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.446 -0.262 . . . . 63.140000000000001 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 p -129.11 -57.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.902 0.382 . . . . 72.150000000000006 110.799 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.17 158.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 74.420000000000002 111.13 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt -173.99 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 73.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.73 -71.47 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.214 -0.448 . . . . 71.319999999999993 111.079 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -172.67 132.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 74.540000000000006 110.928 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -130.69 110.52 11.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 74.519999999999996 110.882 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.462 ' CG1' HD22 ' A' ' 34' ' ' LEU . 24.9 t -131.64 145.43 35.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.157 -0.474 . . . . 74.129999999999995 111.098 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.475 HG23 ' CG2' ' A' ' 59' ' ' VAL . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 73.319999999999993 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.310000000000002 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 62.140000000000001 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.418 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 74.010000000000005 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.239999999999995 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.310000000000002 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 70.200000000000003 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.554 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.219999999999999 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.430000000000007 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.450000000000003 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 74.239999999999995 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.510000000000005 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 19' ' ' GLN . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.340000000000003 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' CB ' ' HA3' ' A' ' 52' ' ' GLY . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 73.019999999999996 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.46 ' N ' HD11 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.099999999999994 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.464 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 75.540000000000006 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.464 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.409999999999997 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.409999999999997 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 72.430000000000007 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.319999999999993 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 74.120000000000005 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 75.019999999999996 110.955 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.462 HD22 ' CG1' ' A' ' 8' ' ' VAL . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.409999999999997 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.833 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.329999999999998 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.444 ' HB3' ' CD2' ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.140000000000001 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.409999999999997 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.549999999999997 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 75.030000000000001 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.030000000000001 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.417 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.310000000000002 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.439999999999998 111.086 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 75.310000000000002 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 71.219999999999999 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 62.200000000000003 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.319999999999993 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.540000000000006 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.299999999999997 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 72.109999999999999 111.15 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.472 ' HA3' ' CB ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 75.25 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.417 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.109999999999999 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 73.530000000000001 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.439999999999998 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.329999999999998 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.140000000000001 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.140000000000001 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.475 ' CG2' HG23 ' A' ' 10' ' ' VAL . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 71.329999999999998 111.176 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.451 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.467 ' N ' HG13 ' A' ' 10' ' ' VAL . 2.2 mtt180 -50.9 143.99 9.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.129999999999995 110.849 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.408 ' HG3' ' N ' ' A' ' 63' ' ' ASN . 0.2 OUTLIER -84.1 148.58 26.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 75.099999999999994 110.829 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.408 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.0 m-80 -125.96 45.74 2.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 71.219999999999999 110.838 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.3 t -59.12 -50.11 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.530000000000001 110.822 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.55 -149.53 0.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 64.129999999999995 111.097 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 75.6 mtt180 -68.03 140.89 56.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 72.329999999999998 110.814 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.77 -16.68 29.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.48 . . . . 70.430000000000007 111.114 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -102.64 25.99 8.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 73.430000000000007 111.039 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.83 83.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 111.1 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -119.5 135.77 54.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 71.030000000000001 110.859 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.21 165.11 19.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.832 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.039 -0.528 . . . . 74.319999999999993 110.847 -179.859 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.439 -0.264 . . . . 74.349999999999994 112.439 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -77.07 -45.81 25.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.932 0.396 . . . . 73.319999999999993 110.91 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 38.5 m -56.67 137.24 54.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 74.519999999999996 111.162 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -124.73 -61.92 1.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 71.219999999999999 110.895 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.429 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -57.78 130.02 44.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 74.150000000000006 111.142 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' A' ' 5' ' ' ALA . 1.8 tt0 35.98 85.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.857 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -82.21 98.39 8.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 75.25 110.877 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t -129.68 142.57 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.400000000000006 111.141 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.119999999999997 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.467 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 72.25 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.477 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 75.430000000000007 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.349999999999994 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.558 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.558 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.439999999999998 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.510000000000005 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.432 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.329999999999998 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 75.140000000000001 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.432 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.230000000000004 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.3 mm-40 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.519999999999996 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 74.510000000000005 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 74.340000000000003 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.455 ' OE1' ' N ' ' A' ' 19' ' ' GLN . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 75.150000000000006 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.493 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 74.239999999999995 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.329999999999998 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.421 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.319999999999993 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.409999999999997 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.439999999999998 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.477 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.219999999999999 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.299999999999997 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 74.140000000000001 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.466 HD11 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.120000000000005 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.946 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.049999999999997 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 63.140000000000001 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.430000000000007 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 75.109999999999999 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.229999999999997 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.499 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.140000000000001 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.209999999999994 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.521 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.140000000000001 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 111.098 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.030000000000001 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.441 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 73.099999999999994 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.219999999999999 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 73.150000000000006 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.482 ' CA ' HD12 ' A' ' 24' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.140000000000001 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.493 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 72.209999999999994 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.521 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.329999999999998 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 72.409999999999997 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.499 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.120000000000005 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.329999999999998 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 74.150000000000006 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.467 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 64.439999999999998 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.407 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.52 139.07 39.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 74.329999999999998 110.837 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 179.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 75.409999999999997 110.873 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -122.74 41.17 3.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 62.109999999999999 110.861 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.6 t -87.72 -61.74 1.65 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 62.539999999999999 110.846 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.93 94.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 74.019999999999996 111.057 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 57.4 170.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.472 . . . . 73.120000000000005 110.891 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.34 -43.25 11.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 73.430000000000007 111.114 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -47.14 -55.65 8.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 75.129999999999995 111.123 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.49 151.93 3.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 65.510000000000005 111.164 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 59.61 102.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 75.019999999999996 110.83 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 72' ' ' SER . 1.6 t -108.09 99.49 8.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 72.409999999999997 110.827 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 71' ' ' SER . 34.5 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.299999999999997 110.81 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.233 . . . . 62.420000000000002 112.516 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 p -160.74 173.93 14.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.837 0.351 . . . . 71.120000000000005 110.914 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -45.96 118.96 2.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 73.209999999999994 111.174 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 ttm -167.82 -50.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 70.120000000000005 110.884 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.66 155.02 27.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 72.109999999999999 111.101 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 66.12 104.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 74.099999999999994 110.87 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -153.65 126.64 8.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.25 110.944 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -130.17 146.46 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 74.430000000000007 111.166 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.140000000000001 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.474 HG23 ' CG2' ' A' ' 59' ' ' VAL . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 75.219999999999999 111.126 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 65.140000000000001 111.018 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 74.140000000000001 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.439999999999998 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.482 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.140000000000001 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.120000000000005 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.482 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 72.530000000000001 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.019999999999996 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.319999999999993 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.209999999999994 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.349999999999994 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.402 ' HA ' ' N ' ' A' ' 53' ' ' PHE . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.209999999999994 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.485 ' HB2' ' CA ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 75.019999999999996 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.120000000000005 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.472 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 72.400000000000006 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.425 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 73.209999999999994 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.420000000000002 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.200000000000003 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.019999999999996 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' CZ ' ' HE3' ' A' ' 62' ' ' LYS . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 72.340000000000003 110.931 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.481 ' CD1' ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.219999999999999 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.439999999999998 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.467 ' CD1' ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 74.530000000000001 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.464 ' CD1' HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.467 ' HB3' ' CD1' ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.310000000000002 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 62.109999999999999 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.120000000000005 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.239999999999995 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.513 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 75.299999999999997 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 75.510000000000005 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.441 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 75.109999999999999 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.425 ' O ' ' CG2' ' A' ' 51' ' ' THR . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.481 ' O ' ' CD1' ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 74.409999999999997 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.445 ' HB2' ' CD2' ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.409999999999997 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 72.129999999999995 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.551 ' C ' ' ND2' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.439999999999998 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 74.5 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.477 ' CA ' HD11 ' A' ' 24' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' CA ' ' HB2' ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.240000000000002 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.441 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.439999999999998 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.340000000000003 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.513 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.430000000000007 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 74.230000000000004 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.319999999999993 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.417 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.230000000000004 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.474 ' CG2' HG23 ' A' ' 10' ' ' VAL . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.019999999999996 111.117 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.445 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.109999999999999 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.45 ' N ' HG11 ' A' ' 10' ' ' VAL . 8.7 ptm180 -54.63 142.56 27.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 71.349999999999994 110.901 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.456 ' HE3' ' CZ ' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -62.68 165.56 6.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.464 . . . . 73.420000000000002 110.956 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.1 43.23 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.424 . . . . 62.409999999999997 110.924 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 t -56.8 116.21 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 74.030000000000001 110.827 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.55 45.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 111.111 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -124.81 139.16 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 73.340000000000003 110.923 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.68 -20.03 28.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 65.439999999999998 111.116 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.01 29.97 5.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 63.119999999999997 111.083 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.53 132.02 8.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 71.140000000000001 111.118 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -51.99 122.76 8.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 75.349999999999994 110.907 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 89.3 p -133.88 82.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 75.299999999999997 110.886 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 110.92 -179.766 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.4 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.838 0.351 . . . . 75.42 111.115 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.087 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.84 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 61.34 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.44 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.13 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.43 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 64.5 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.33 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.33 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.3 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.52 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 62.22 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.33 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.12 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.887 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.886 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.41 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 72.05 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.52 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.13 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.24 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 74.4 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 73.33 110.958 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.31 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.784 HD21 ' HB3' ' A' ' 37' ' ' ASP . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.03 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.844 HD12 HG21 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 60.32 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.784 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.41 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.22 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 62.12 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.34 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.44 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.42 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 71.31 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.31 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.402 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.04 110.828 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.844 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 63.32 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 44.24 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 60.1 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.44 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.05 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 61.44 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.412 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 63.1 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.421 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.41 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.84 ' HA ' HG12 ' A' ' 10' ' ' VAL . 16.0 ptm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.51 110.825 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.831 0.348 . . . . 64.44 111.14 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 64.44 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.722 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.13 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 70.41 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 63.03 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.44 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.51 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.53 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.507 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.8 mp0 -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 53.31 110.907 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.01 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.1 110.869 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.15 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.24 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.11 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 73.14 110.923 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 51.22 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 65.5 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.34 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.485 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.45 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 52.2 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.3 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.828 HD12 HG21 ' A' ' 51' ' ' THR . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.43 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.3 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.528 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.52 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.03 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 71.23 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 72.23 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.14 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.03 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.427 HG21 HD13 ' A' ' 32' ' ' LEU . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.51 111.148 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 52.05 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 64.33 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 52.42 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.828 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.31 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.422 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 71.0 112.484 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 72.5 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 33.34 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 72.12 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.485 ' HA ' HG22 ' A' ' 59' ' ' VAL . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 62.43 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 56' ' ' SER . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.54 111.14 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.23 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.708 ' HA ' HG12 ' A' ' 10' ' ' VAL . 13.5 ptm180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 65.12 110.837 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.912 0.387 . . . . 62.31 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 73.11 111.133 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.47 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.33 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 71.54 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.457 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.457 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.53 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.01 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 55.43 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.04 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.11 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 51.03 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.11 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 64.44 110.816 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 64.35 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.44 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.481 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.31 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 72.11 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 52.33 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' HG12 ' A' ' 9' ' ' VAL . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 65.33 110.843 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' A' ' 37' ' ' ASP . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 54.44 110.878 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.503 HD12 ' CG2' ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.31 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.504 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 71.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.43 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.34 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.423 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.2 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.438 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.02 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.14 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 65.45 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.51 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.14 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 70.41 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.551 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.23 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.33 110.873 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 50.11 111.163 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.52 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.607 ' HA ' HG22 ' A' ' 59' ' ' VAL . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.895 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.05 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.475 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.607 HG22 ' HA ' ' A' ' 56' ' ' SER . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 55.44 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 65.42 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 54.12 110.882 -179.909 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.911 0.386 . . . . 65.2 111.131 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.23 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.677 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 54.53 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.494 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 61.33 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 61.01 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.514 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 70.12 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.514 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 71.44 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.45 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 63.55 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.04 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 50.22 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 60.13 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.44 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.42 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.11 110.94 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 63.34 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.475 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.446 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 71.32 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 64.23 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.22 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 73.42 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.721 HD12 HG12 ' A' ' 44' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.556 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 55.43 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.596 ' HB3' HD21 ' A' ' 34' ' ' LEU . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.824 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.3 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.24 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.45 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.14 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 73.55 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.721 HG12 HD12 ' A' ' 34' ' ' LEU . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 53.22 111.157 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.03 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 71.03 110.849 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 52.44 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 65.4 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 63.24 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.556 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 73.11 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 45.44 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.52 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 65.42 111.148 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.23 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.418 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 55.13 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.677 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.0 ptp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.845 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.851 0.358 . . . . 74.13 111.106 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.24 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.475 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 64.32 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 71.33 111.146 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.24 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 70.41 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.2 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.42 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 62.52 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 63.15 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.576 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 64.53 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.24 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.15 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.51 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.91 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.433 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.576 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.45 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 63.25 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.23 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.54 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.469 ' C ' HD22 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 64.34 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.603 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 65.11 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 65.04 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 54.43 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 51' ' ' THR . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 52.01 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.22 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 34' ' ' LEU . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.4 110.824 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.14 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.14 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.937 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.548 ' CE3' HD11 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.14 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 34' ' ' LEU . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 51.35 111.165 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 63.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.428 ' HA ' HD12 ' A' ' 32' ' ' LEU . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.01 110.942 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.24 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.552 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.22 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.15 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.633 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.12 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.3 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.32 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.15 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.21 112.365 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.42 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.11 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' HG21 ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.15 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 62.42 110.903 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.454 ' CG1' ' HG2' ' A' ' 61' ' ' ARG . 70.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 74.24 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 54.34 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 61' ' ' ARG . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.3 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.1 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.35 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.04 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 70.1 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.01 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 51.12 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.55 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.536 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.89 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.49 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.96 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.54 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.45 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.11 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.45 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.918 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.54 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB3' ' A' ' 37' ' ' ASP . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.12 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 64.43 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.51 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.7 ' HB3' HD11 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.21 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.1 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 65.11 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.42 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.408 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.41 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.41 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.532 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.444 HG12 HD12 ' A' ' 34' ' ' LEU . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.13 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.487 ' O ' HD12 ' A' ' 32' ' ' LEU . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.645 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.869 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.436 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.31 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.1 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 71.21 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.43 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.11 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.43 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.4 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 64.31 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.45 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.438 ' HB ' HG23 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.51 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.586 ' HA ' HG12 ' A' ' 10' ' ' VAL . 27.2 mtm105 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.15 110.888 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.838 0.351 . . . . 45.21 111.154 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.55 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' ' 34' ' ' LEU . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 54.31 111.127 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 72.04 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.05 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.573 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.45 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 61.44 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.44 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.524 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 63.32 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.55 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.24 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.15 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.405 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 72.55 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 72.43 110.91 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 70.32 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 64.12 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.413 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 54.41 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.1 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 70.24 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.788 ' C ' HD22 ' A' ' 32' ' ' LEU . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 53.43 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.788 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 63.21 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 HG12 ' A' ' 44' ' ' VAL . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 71.23 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.572 ' HB3' HD21 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.22 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 70.34 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.52 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.421 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 65.15 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 55.13 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.22 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.581 HG12 HD12 ' A' ' 34' ' ' LEU . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 34.32 111.083 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.745 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 54.34 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.42 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.404 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.4 110.852 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.561 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.35 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.897 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.544 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.34 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.11 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 55.0 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.03 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 63.11 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.03 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.192 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.452 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.2 ptm180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 62.44 110.907 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.4 HG11 HD23 ' A' ' 34' ' ' LEU . 94.8 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.935 0.398 . . . . 72.32 111.076 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.32 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG13 ' HB2' ' A' ' 34' ' ' LEU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.483 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.32 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 65.34 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.42 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.479 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.12 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 71.22 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.33 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.2 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 71.52 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.33 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.553 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.523 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.956 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.401 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.891 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 64.21 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.2 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.52 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.435 ' CD ' HD21 ' A' ' 32' ' ' LEU . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 43.14 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.31 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.642 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 45.32 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.02 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.637 HD21 ' OD2' ' A' ' 37' ' ' ASP . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.59 HD12 HG21 ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.42 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.21 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' HD21 ' A' ' 34' ' ' LEU . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 73.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.13 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.32 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 65.21 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.25 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.471 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.628 HG12 HD12 ' A' ' 34' ' ' LEU . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 64.21 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.426 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.912 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 53.13 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.458 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.2 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 50.21 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.31 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.59 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.24 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.14 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.3 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 42' ' ' TRP . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.14 111.126 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.12 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 33.31 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.405 ' HB ' HG23 ' A' ' 10' ' ' VAL . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 63.43 111.167 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.43 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.55 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.523 ' HA ' HG12 ' A' ' 10' ' ' VAL . 10.9 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.864 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.867 0.365 . . . . 74.44 111.096 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 41.43 111.115 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.585 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 65.3 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.412 ' HB1' HD12 ' A' ' 26' ' ' ILE . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.31 111.042 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.4 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.22 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.526 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 54.34 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.646 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.35 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.32 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.44 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.21 110.944 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.646 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.01 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.47 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 54.25 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 71.33 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.22 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 64.23 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 52.5 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 73.22 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.3 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 61.11 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 51' ' ' THR . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 62.34 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.506 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.21 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 72.01 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.4 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 42.41 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.493 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 72.22 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.506 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.537 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.5 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.51 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.04 110.86 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.634 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.929 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.42 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 55.21 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 51.53 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.49 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.12 111.158 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.34 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 73.13 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.12 111.112 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.531 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.33 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.23 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.3 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.531 ' CD1' ' HG2' ' A' ' 55' ' ' PRO . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 60.2 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.407 ' HB ' HG23 ' A' ' 10' ' ' VAL . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 53.02 111.118 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 70.22 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 ptm180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 52.35 110.872 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.803 HG11 HD23 ' A' ' 34' ' ' LEU . 42.3 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.888 0.375 . . . . 74.13 111.108 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.803 HG12 ' HA ' ' A' ' 61' ' ' ARG . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.01 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.22 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.544 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 71.32 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 52.11 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.4 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.486 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 63.23 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 51.15 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 60.33 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 64.22 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.2 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 72.24 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.53 110.904 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.23 110.969 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 43.32 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 51.15 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.24 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.31 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.811 ' C ' HD22 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 71.11 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.847 HD21 ' CG ' ' A' ' 37' ' ' ASP . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.41 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.847 ' CG ' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 65.11 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 74.31 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.12 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.02 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.53 ' O ' HD12 ' A' ' 34' ' ' LEU . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.03 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 61.41 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.721 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.42 110.873 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.3 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.444 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.3 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.56 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 24' ' ' LEU . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.34 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.479 HG21 HD12 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 61.22 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.561 ' H ' HD12 ' A' ' 24' ' ' LEU . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.501 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.516 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 72.24 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 65.44 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.418 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 64.22 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 44.43 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.31 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.21 111.118 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.424 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.01 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.803 ' HA ' HG12 ' A' ' 10' ' ' VAL . 74.3 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 74.02 110.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.885 0.374 . . . . 50.25 111.128 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.51 111.127 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.729 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 54.54 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.462 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.13 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 53.44 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 72.53 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.54 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 64.22 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.655 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.42 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 64.35 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.43 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 53.23 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.655 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.24 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.33 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.41 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.472 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 63.32 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.32 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.32 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.3 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.458 HD13 HG21 ' A' ' 44' ' ' VAL . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 53.23 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.42 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.478 HD21 ' HB3' ' A' ' 37' ' ' ASP . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 60.43 110.951 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.472 HD12 ' CG2' ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 61.52 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB3' HD21 ' A' ' 34' ' ' LEU . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.23 110.87 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 52.32 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 71.02 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.13 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.409 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.42 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.484 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 73.42 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.458 HG21 HD13 ' A' ' 32' ' ' LEU . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.13 111.094 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.13 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.31 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.52 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.427 ' OD1' ' C ' ' A' ' 49' ' ' ASN . 0.1 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.495 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.24 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 71.01 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 72.52 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 54.45 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.1 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 59' ' ' VAL . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.41 110.883 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.52 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.556 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 61.3 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 56' ' ' SER . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.35 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.2 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.729 ' HA ' HG12 ' A' ' 10' ' ' VAL . 14.3 ptm180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.31 110.937 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.872 0.368 . . . . 73.12 111.082 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.14 111.132 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 65.41 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.442 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.12 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.02 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 72.03 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.42 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 61.21 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.765 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.42 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.12 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.1 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.23 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.765 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 73.41 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.799 HD13 ' N ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.21 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.483 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.24 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 45.34 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 65.23 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 64.45 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.442 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.24 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HG21 ' A' ' 44' ' ' VAL . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.04 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.4 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 52.42 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.972 HD12 HG21 ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 71.4 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 74.53 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 34' ' ' LEU . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.05 110.929 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.23 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 63.32 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.14 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.23 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 74.55 110.905 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.14 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.565 HG21 HD13 ' A' ' 32' ' ' LEU . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.11 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.658 ' HB2' HD21 ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.13 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.546 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.11 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.972 HG21 HD12 ' A' ' 35' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.1 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.799 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.13 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 63.11 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.34 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.2 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 45.43 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.477 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 63.43 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.469 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 60.24 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.403 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 63.24 110.945 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.666 ' HA ' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 73.43 110.932 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.4 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.849 0.357 . . . . 75.25 111.226 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 74.41 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.15 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.12 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 61.33 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.44 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 64.3 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.13 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 72.21 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.43 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.44 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.34 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.35 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 74.35 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.52 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.929 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 61.32 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 54.41 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 64.33 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.53 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.851 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.35 110.828 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.35 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 37' ' ' ASP . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 74.13 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' CD1' HG21 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 43.43 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.474 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.44 110.843 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 44.23 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.41 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.03 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 72.14 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 71.1 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.492 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.422 ' HA ' HD12 ' A' ' 32' ' ' LEU . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 62.45 110.86 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 60.34 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 71.42 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 64.44 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.449 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.24 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.21 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.11 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 72.13 111.105 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.33 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 53.31 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 64.53 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.154 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.436 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.24 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.654 ' HA ' HG12 ' A' ' 10' ' ' VAL . 8.7 mtm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.05 110.86 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.841 0.353 . . . . 64.42 111.098 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 71.04 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 62.32 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 11' ' ' VAL . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.24 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.41 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.484 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.1 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 72.44 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.622 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 62.53 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.53 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 64.31 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 72.51 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.54 110.871 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.622 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 43.41 110.895 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.12 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.479 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.43 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.43 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.43 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.701 ' C ' HD22 ' A' ' 32' ' ' LEU . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.3 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 44.34 110.923 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.53 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.729 HD12 HG12 ' A' ' 44' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.595 HD12 HG21 ' A' ' 51' ' ' THR . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.954 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.02 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.594 ' HB3' HD21 ' A' ' 34' ' ' LEU . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 52.14 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.23 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.13 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.43 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.729 HG12 HD12 ' A' ' 34' ' ' LEU . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.35 111.105 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.695 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.44 110.883 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 71.11 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 42.4 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.24 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 64.12 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 62.21 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.595 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 60.4 111.203 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.54 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.23 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.34 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.24 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 65.55 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.498 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 70.01 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.43 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.21 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 10' ' ' VAL . 4.8 ptm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.946 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.79 HG11 HD23 ' A' ' 34' ' ' LEU . 18.2 t . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.855 0.359 . . . . 63.33 111.064 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 51.33 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.501 HG23 ' HB ' ' A' ' 59' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.54 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.419 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 73.35 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 21.52 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.23 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.15 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.11 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.32 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.23 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.4 mm100 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.01 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 53.54 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 62.24 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.04 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.491 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.33 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.536 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.45 110.946 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.419 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.13 110.879 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.21 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.465 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 62.55 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.1 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.23 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 61.24 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.419 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.23 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 45' ' ' ARG . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.947 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.79 HD23 HG11 ' A' ' 8' ' ' VAL . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.45 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.42 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.613 ' CG ' HD21 ' A' ' 34' ' ' LEU . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 71.41 110.791 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 53.1 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 71.35 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.45 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.449 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 61.5 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.45 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.599 ' O ' HD23 ' A' ' 32' ' ' LEU . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.904 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.22 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.15 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.2 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 61.11 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 72.23 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.23 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.02 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 54.34 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 64.2 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.501 ' HB ' HG23 ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 71.1 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.426 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.855 -179.902 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.342 . . . . 52.54 111.173 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 62.3 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.442 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.35 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 43.33 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' LYS . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 32.12 111.083 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.2 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.44 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.33 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.56 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.636 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 61.11 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 17' ' ' VAL . 2.0 mp0 -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.13 110.928 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 62.13 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.43 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.636 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.12 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 70.55 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.3 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.22 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.33 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 73.33 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.3 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.786 HD21 ' HB3' ' A' ' 37' ' ' ASP . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.911 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.915 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.786 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.53 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.32 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 54.02 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 61.31 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.528 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 72.3 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.34 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.52 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 53.45 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 63.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.575 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.41 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.33 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 71.02 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.21 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.507 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 64.45 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 63.31 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.13 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.442 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 72.44 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.51 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.11 110.909 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.921 0.391 . . . . 54.23 111.057 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.43 111.101 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.855 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.544 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.1 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 43.44 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.58 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 71.12 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 73.2 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.31 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.576 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.03 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 63.02 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.769 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.04 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.15 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 72.03 110.886 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 72.11 110.869 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.416 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.24 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.769 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 63.22 110.949 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.13 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.22 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.11 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.21 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.409 ' HA ' HG12 ' A' ' 9' ' ' VAL . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.856 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.41 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 HG21 ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.44 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.812 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.52 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 51.54 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' HD11 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.43 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.581 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 63.11 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.504 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 64.1 110.87 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.609 ' HA ' HD12 ' A' ' 32' ' ' LEU . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.12 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.14 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 50.12 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.03 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 64.41 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 42' ' ' TRP . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 52.44 111.093 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.04 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 52.15 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.33 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.506 HG21 HG21 ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.21 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.33 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.547 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.8 ptp180 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.873 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.525 HG11 HD23 ' A' ' 34' ' ' LEU . 24.9 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.911 0.386 . . . . 61.52 111.098 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 70.24 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.876 HG12 ' HA ' ' A' ' 61' ' ' ARG . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 64.32 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.31 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 24.33 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 70.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.24 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.31 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 64.03 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.22 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.43 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.45 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 73.51 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.51 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.594 ' N ' HD12 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.1 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.482 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 34.52 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.482 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.41 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.41 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 64.13 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.464 HD13 HG21 ' A' ' 44' ' ' VAL . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.955 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 37' ' ' ASP . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.05 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 51' ' ' THR . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.833 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.33 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.41 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.55 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.03 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.464 HG21 HD13 ' A' ' 32' ' ' LEU . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.14 111.086 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 73.23 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 53.11 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.32 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.84 HG21 HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' N ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 51.13 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.11 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 63.12 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.14 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.33 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.14 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 64.32 111.176 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.457 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.876 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.2 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.13 110.849 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.866 0.365 . . . . 71.24 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.12 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.583 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 71.45 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.575 HG23 ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.35 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.55 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.55 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.51 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 74.33 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.23 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.6 mm100 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 63.21 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 71.12 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 61.45 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.599 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.805 HD13 ' N ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.21 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.438 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.33 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.41 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.44 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HD2' HG23 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.12 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 51' ' ' THR . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.946 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.05 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 61.32 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.43 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 74.33 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.23 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.504 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.21 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 70.43 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.853 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.03 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.647 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.11 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 71.3 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.22 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 49' ' ' ASN . 0.1 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 64.34 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 35' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.14 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.805 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 64.33 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.33 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 54.41 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.504 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.12 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.53 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.31 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 61.23 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 43.44 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.413 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 71.31 110.837 -179.897 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.49 ' CG1' HD23 ' A' ' 34' ' ' LEU . 73.2 t . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.829 0.347 . . . . 74.43 111.166 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.14 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' CA ' ' A' ' 61' ' ' ARG . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.41 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.414 HG22 ' N ' ' A' ' 12' ' ' ALA . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 63.23 111.126 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.414 ' N ' HG22 ' A' ' 11' ' ' VAL . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.11 111.018 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 72.5 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.49 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.12 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.12 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.597 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 64.2 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.02 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.21 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.35 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.597 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.82 HD13 ' N ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 74.44 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 54.32 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.42 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.2 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.02 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.697 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.931 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.832 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.22 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.44 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.833 HD11 ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.867 HD12 HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 64.22 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.833 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.31 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 32.34 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.24 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.524 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 74.42 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 73.51 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.446 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.54 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.832 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 54.22 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.673 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 71.04 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.551 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.44 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 65.31 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.867 HG21 HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.11 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.82 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.24 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.446 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.44 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.11 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.524 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.43 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 63.12 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 51.2 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.432 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.02 111.117 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.448 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.11 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CA ' HG12 ' A' ' 10' ' ' VAL . 8.7 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 70.55 110.901 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 43.21 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m -156.87 83.87 0.95 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.855 0.36 . . . . 73.01 110.893 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.3 m -77.2 115.55 17.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 62.11 111.138 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm 67.79 148.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.888 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.74 82.33 5.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 70.41 111.095 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -156.76 90.9 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.297 -0.411 . . . . 74.5 110.855 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -140.3 38.45 1.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.4 110.844 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.4 t -149.12 125.27 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 75.42 111.115 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.087 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.84 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 61.34 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.44 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.13 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.43 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 64.5 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.33 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.33 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.3 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.52 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 62.22 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.33 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.12 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.887 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.886 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.41 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 72.05 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.52 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.13 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.24 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 74.4 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 73.33 110.958 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.31 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.784 HD21 ' HB3' ' A' ' 37' ' ' ASP . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.03 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.844 HD12 HG21 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 60.32 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.784 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.41 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.22 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 62.12 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.34 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.44 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.42 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 71.31 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.31 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.402 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.04 110.828 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.844 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 63.32 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 44.24 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 60.1 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.44 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.05 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 61.44 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.412 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 63.1 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.421 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.41 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.84 ' HA ' HG12 ' A' ' 10' ' ' VAL . 16.0 ptm180 -63.18 142.48 58.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.51 110.825 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' CB ' ' A' ' 63' ' ' ASN . 0.1 OUTLIER -109.4 -166.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.493 . . . . 64.54 110.889 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.445 ' CB ' ' O ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER 79.04 25.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.924 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 61.3 p -62.32 173.73 1.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 45.23 110.888 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.25 -157.04 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.1 111.079 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -45.35 142.6 2.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.33 110.844 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.26 76.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 64.35 111.034 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.33 -58.23 8.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.54 111.081 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.82 120.76 26.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.105 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 71' ' ' SER . 6.7 p-10 -123.82 84.9 2.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 74.23 110.93 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 70' ' ' ASN . 1.8 t 35.47 83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.3 110.889 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 70.42 110.889 -179.735 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.495 -0.242 . . . . 51.43 112.495 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.17 132.38 45.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.419 . . . . 62.53 110.84 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -91.25 163.3 14.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 61.43 111.176 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.3 mtm -84.73 138.1 32.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.278 -0.419 . . . . 72.5 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.79 176.78 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 62.01 111.092 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 57.29 106.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 62.44 110.857 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -123.96 85.21 2.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 53.41 110.844 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t -108.78 146.22 14.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 64.44 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 64.44 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.722 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.13 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 70.41 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 63.03 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.44 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.51 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.53 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.507 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.8 mp0 -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 53.31 110.907 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.01 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.1 110.869 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.15 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.24 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.11 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 73.14 110.923 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 51.22 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 65.5 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.34 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.485 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.45 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 52.2 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.3 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.828 HD12 HG21 ' A' ' 51' ' ' THR . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.43 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.3 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.528 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.52 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.03 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 71.23 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 72.23 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.14 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.03 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.427 HG21 HD13 ' A' ' 32' ' ' LEU . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.51 111.148 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 52.05 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 64.33 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 52.42 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.828 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.31 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.422 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 71.0 112.484 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 72.5 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 33.34 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 72.12 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.485 ' HA ' HG22 ' A' ' 59' ' ' VAL . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 62.43 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 56' ' ' SER . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.54 111.14 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.23 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.708 ' HA ' HG12 ' A' ' 10' ' ' VAL . 13.5 ptm180 -67.03 143.83 56.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 65.12 110.837 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.15 162.06 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 63.23 110.961 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -136.15 35.1 2.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 74.41 110.87 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -58.9 85.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 64.34 110.872 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.9 88.15 2.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 72.22 111.054 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 60.92 128.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.04 110.917 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.65 -50.66 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 75.45 111.065 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.5 -43.27 62.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 73.02 111.093 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -99.95 94.12 6.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.437 . . . . 63.14 111.15 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.442 ' CG ' ' O ' ' A' ' 70' ' ' ASN . 0.7 OUTLIER -178.7 117.87 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.898 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 p 59.85 120.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.14 110.847 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 64.33 110.863 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.555 -0.218 . . . . 75.44 112.555 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m 39.57 50.97 2.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 74.33 110.82 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.8 m -53.58 114.87 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 70.02 111.114 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.6 ttt -125.12 177.59 6.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.168 -0.469 . . . . 71.14 110.882 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.94 177.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 61.25 111.142 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -101.4 112.11 24.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 51.23 110.871 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -104.71 -175.86 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 74.52 110.875 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -116.56 142.65 29.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 62.31 111.135 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 73.11 111.133 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.47 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.33 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 71.54 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.457 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.457 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.53 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.01 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 55.43 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.04 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.11 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 51.03 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.11 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 64.44 110.816 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 64.35 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.44 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.481 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.31 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 72.11 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 52.33 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' HG12 ' A' ' 9' ' ' VAL . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 65.33 110.843 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' A' ' 37' ' ' ASP . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 54.44 110.878 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.503 HD12 ' CG2' ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.31 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.504 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 71.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.43 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.34 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.423 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.2 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.438 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.02 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.14 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 65.45 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.51 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.14 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 70.41 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.551 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.23 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.33 110.873 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 50.11 111.163 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.52 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.607 ' HA ' HG22 ' A' ' 59' ' ' VAL . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.895 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.05 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.475 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.607 HG22 ' HA ' ' A' ' 56' ' ' SER . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 55.44 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 65.42 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -63.34 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 54.12 110.882 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.1 165.2 0.52 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.1 110.918 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -171.45 38.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.868 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 23.6 m -74.34 85.07 1.95 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 73.11 110.837 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.4 77.44 7.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.131 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.06 120.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 71.42 110.887 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.11 62.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 74.34 111.122 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -83.66 35.55 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 44.42 111.131 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.02 -48.04 11.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.126 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -110.76 177.35 4.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 73.43 110.893 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 72' ' ' SER . 3.9 m -76.43 80.96 3.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 54.23 110.924 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.404 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 71.23 110.919 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.474 -0.25 . . . . 74.45 112.474 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.94 96.93 4.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.936 0.398 . . . . 61.22 110.858 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.0 m -38.04 -61.7 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 64.23 111.165 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt 67.75 136.68 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 63.4 110.896 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.49 129.87 43.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.3 -0.409 . . . . 74.1 111.12 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 64.2 161.33 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.884 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -168.21 129.38 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 62.15 110.943 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -133.21 149.03 31.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 65.2 111.131 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.23 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.677 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 54.53 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.494 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 61.33 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 61.01 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.514 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 70.12 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.514 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 71.44 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.45 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 63.55 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.04 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 50.22 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 60.13 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.44 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.42 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.11 110.94 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 63.34 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.475 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.446 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 71.32 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 64.23 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.22 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 73.42 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.721 HD12 HG12 ' A' ' 44' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.556 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 55.43 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.596 ' HB3' HD21 ' A' ' 34' ' ' LEU . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.824 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.3 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.24 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.45 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.14 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 73.55 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.721 HG12 HD12 ' A' ' 34' ' ' LEU . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 53.22 111.157 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.03 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 71.03 110.849 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 52.44 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 65.4 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 63.24 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.556 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 73.11 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 45.44 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.52 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 65.42 111.148 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.23 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.418 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 55.13 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.677 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.0 ptp180 -67.99 140.41 56.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.845 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 168.42 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 61.44 110.896 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.425 ' CG ' ' O ' ' A' ' 63' ' ' ASN . 22.6 t30 -89.61 45.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.22 -0.445 . . . . 73.34 110.902 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.8 p -88.31 48.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 62.22 110.851 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.25 42.79 1.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 65.41 111.095 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -88.9 133.54 34.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 74.53 110.869 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.57 -40.8 12.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 65.32 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.43 -55.03 17.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 72.33 111.115 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.66 96.41 8.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.54 111.179 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 67.24 166.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.849 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.0 m 51.91 91.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 54.11 110.872 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 91.6 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.838 -179.806 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.472 -0.251 . . . . 51.3 112.472 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.62 130.05 53.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.94 0.4 . . . . 63.13 110.85 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 m -73.92 108.17 6.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 75.3 111.152 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm -168.76 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 62.31 110.936 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.8 95.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.095 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 65.28 136.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 73.34 110.85 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -93.51 137.93 32.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.063 -0.517 . . . . 73.15 110.856 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t -120.85 145.88 26.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 74.13 111.106 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.24 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.475 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 64.32 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 71.33 111.146 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.24 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 70.41 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.2 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.42 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 62.52 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 63.15 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.576 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 64.53 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.24 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.15 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.51 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.91 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.45 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 63.25 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.23 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.54 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.469 ' C ' HD22 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 64.34 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.603 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 65.11 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 65.04 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 54.43 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 51' ' ' THR . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 52.01 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.22 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 34' ' ' LEU . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.4 110.824 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.14 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.14 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.937 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.548 ' CE3' HD11 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.14 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 34' ' ' LEU . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 51.35 111.165 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 63.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.428 ' HA ' HD12 ' A' ' 32' ' ' LEU . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.01 110.942 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.24 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.552 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.22 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.15 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.633 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.12 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.3 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.32 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.15 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.21 112.365 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.42 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.11 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' HG21 ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.15 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -50.62 144.01 8.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 62.42 110.903 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.5 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 15.9 tttm -52.0 -68.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.863 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.5 ' ND2' ' O ' ' A' ' 62' ' ' LYS . 0.5 OUTLIER 38.6 69.5 0.26 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 61.31 110.933 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.5 t -79.29 -61.17 2.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 50.22 110.852 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.7 97.77 9.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 63.42 111.076 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 53.04 100.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 71.12 110.839 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.74 33.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 74.21 111.104 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.77 36.13 0.85 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.223 -0.444 . . . . 44.54 111.082 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.64 92.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 53.35 111.081 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 71' ' ' SER . 25.0 m-80 -152.81 -47.3 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 74.42 110.883 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER 34.72 88.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 63.54 110.835 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 52.43 110.874 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.471 -0.252 . . . . 73.34 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 t -120.15 86.48 2.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 63.05 110.817 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.2 m -82.53 145.86 29.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 65.5 111.179 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtm -144.72 -61.68 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 74.1 110.83 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.01 99.74 6.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 74.2 111.119 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -151.89 91.11 1.59 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 74.53 110.911 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -114.69 137.45 51.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.836 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.454 ' CG1' ' HG2' ' A' ' 61' ' ' ARG . 70.1 t -124.72 141.84 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 74.24 111.154 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 54.34 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 61' ' ' ARG . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.3 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.1 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.35 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.04 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 70.1 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.01 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 51.12 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.55 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.536 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.89 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.49 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.96 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.54 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.45 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.11 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.45 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.918 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.54 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB3' ' A' ' 37' ' ' ASP . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.12 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 64.43 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.51 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.7 ' HB3' HD11 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.21 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.1 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 65.11 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.42 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.408 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.41 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.41 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.532 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.444 HG12 HD12 ' A' ' 34' ' ' LEU . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.13 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.487 ' O ' HD12 ' A' ' 32' ' ' LEU . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.645 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.869 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.436 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.31 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.1 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 71.21 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.43 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.11 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.43 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.4 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 64.31 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.45 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.438 ' HB ' HG23 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.51 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.586 ' HA ' HG12 ' A' ' 10' ' ' VAL . 27.2 mtm105 -50.28 142.39 10.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.15 110.888 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.54 166.31 0.31 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 72.44 110.861 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -46.74 -23.76 0.47 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 72.1 110.921 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.5 p -87.95 123.23 32.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 74.35 110.833 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -110.79 113.27 25.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 52.44 111.16 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 59.82 121.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.189 -0.46 . . . . 73.4 110.905 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.14 -15.22 59.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 24.33 111.119 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -108.45 35.73 3.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.225 -0.443 . . . . 62.41 111.04 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -36.72 10.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 71.11 111.083 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.1 -53.7 53.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 61.42 110.973 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.55 127.53 7.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 74.13 110.833 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 64.41 110.837 -179.762 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.496 -0.242 . . . . 74.41 112.496 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 m -98.93 102.19 13.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 61.5 110.891 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.9 m -54.82 127.32 27.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 45.0 111.184 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -67.36 147.07 53.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 70.33 110.885 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.99 178.96 3.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 71.41 111.078 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -84.11 100.24 11.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 62.02 110.883 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.53 176.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 71.25 110.881 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.78 143.1 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 45.21 111.154 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.55 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' ' 34' ' ' LEU . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 54.31 111.127 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 72.04 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.05 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.573 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.45 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 61.44 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.44 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.524 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 63.32 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.55 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.24 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.15 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.405 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 72.55 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 72.43 110.91 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 70.32 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 64.12 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 54.41 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.1 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 70.24 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.788 ' C ' HD22 ' A' ' 32' ' ' LEU . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 53.43 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.788 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 63.21 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 HG12 ' A' ' 44' ' ' VAL . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 71.23 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.572 ' HB3' HD21 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.22 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 70.34 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.52 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.421 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 65.15 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 55.13 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.22 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.581 HG12 HD12 ' A' ' 34' ' ' LEU . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 34.32 111.083 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.745 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 54.34 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.42 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.404 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.4 110.852 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.561 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.35 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.897 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.544 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.34 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.11 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 55.0 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.03 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 63.11 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.03 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.192 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.452 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.2 ptm180 -64.89 141.33 58.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 62.44 110.907 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -56.2 143.12 34.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.22 -0.445 . . . . 61.55 110.908 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -101.38 -18.43 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 64.44 110.848 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -84.12 83.78 7.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 65.04 110.902 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -111.01 97.26 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.179 -0.464 . . . . 74.44 111.091 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.418 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . 24.5 mtt180 -63.39 131.9 49.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 74.31 110.906 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.06 -50.76 64.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.155 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.84 -48.88 72.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.31 111.099 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 66' ' ' ARG . . . -68.27 107.34 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 70.12 111.084 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.43 115.17 29.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 70.25 110.91 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.54 96.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 71.14 110.825 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 73.4 110.91 -179.877 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.47 -0.252 . . . . 73.43 112.47 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -49.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 70.53 110.876 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 93.9 m -59.65 137.09 58.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.21 111.141 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mtm -120.67 156.96 30.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.256 -0.429 . . . . 74.42 110.895 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.52 144.88 25.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 74.5 111.12 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.46 104.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 64.41 110.844 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -131.16 -178.89 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 62.54 110.896 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.4 HG11 HD23 ' A' ' 34' ' ' LEU . 94.8 t -133.87 147.2 30.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.076 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.32 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG13 ' HB2' ' A' ' 34' ' ' LEU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.483 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.32 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 65.34 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.42 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.479 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.12 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 71.22 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.33 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.2 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 71.52 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.33 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.523 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.956 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.401 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.891 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 64.21 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.2 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.52 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.435 ' CD ' HD21 ' A' ' 32' ' ' LEU . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 43.14 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.31 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.642 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 45.32 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.02 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.637 HD21 ' OD2' ' A' ' 37' ' ' ASP . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.59 HD12 HG21 ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.42 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.21 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' HD21 ' A' ' 34' ' ' LEU . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 73.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.13 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.32 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 65.21 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.25 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.471 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.628 HG12 HD12 ' A' ' 34' ' ' LEU . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 64.21 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.426 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.912 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 53.13 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.458 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.2 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 50.21 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.31 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.59 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.24 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.14 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.3 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 42' ' ' TRP . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.14 111.126 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.12 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 33.31 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.405 ' HB ' HG23 ' A' ' 10' ' ' VAL . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 63.43 111.167 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.43 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.55 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.523 ' HA ' HG12 ' A' ' 10' ' ' VAL . 10.9 ptm180 -61.38 143.4 55.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.864 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.35 164.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 75.33 110.923 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -130.28 -30.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 54.54 110.851 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -85.24 92.41 8.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 70.23 110.81 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.29 100.93 12.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 74.32 111.101 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.598 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 8.5 mtt180 -79.25 165.63 23.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 72.12 110.882 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.74 -48.76 11.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 63.41 111.082 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -90.04 36.72 0.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 74.45 111.027 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.598 ' HB2' ' HB2' ' A' ' 66' ' ' ARG . . . -98.27 33.98 2.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.114 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -98.62 163.57 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 64.53 110.937 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.4 81.8 2.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 50.5 110.857 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.119 -0.491 . . . . 74.23 110.849 -179.798 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.463 -0.255 . . . . 63.12 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -155.63 -48.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.922 0.392 . . . . 74.31 110.876 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.3 m -59.54 117.77 5.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 71.12 111.102 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.2 mtm 62.71 131.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 73.42 110.92 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.3 170.26 14.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.24 -0.436 . . . . 75.3 111.121 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -139.83 132.0 28.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 74.41 110.896 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -133.95 159.91 39.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.0 110.833 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t -131.3 140.63 47.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 74.44 111.096 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 41.43 111.115 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.585 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 65.3 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.412 ' HB1' HD12 ' A' ' 26' ' ' ILE . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.31 111.042 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.4 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.22 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.526 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 54.34 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.646 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.35 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.32 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.44 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.21 110.944 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.646 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.01 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.47 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 54.25 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 71.33 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.22 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 64.23 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 52.5 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 73.22 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.3 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 61.11 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 51' ' ' THR . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 62.34 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.506 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.21 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 72.01 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.4 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 42.41 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.493 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 72.22 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.506 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.537 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.5 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.51 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.04 110.86 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.634 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.929 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.42 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 55.21 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 51.53 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.49 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.12 111.158 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.34 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 73.13 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.12 111.112 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.531 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.33 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.23 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.3 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.531 ' CD1' ' HG2' ' A' ' 55' ' ' PRO . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 60.2 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.407 ' HB ' HG23 ' A' ' 10' ' ' VAL . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 53.02 111.118 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 70.22 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 ptm180 -64.22 136.44 57.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 52.35 110.872 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -55.06 130.29 41.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 41.44 110.856 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -94.97 37.26 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 62.53 110.936 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.6 t -70.46 174.39 5.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 75.41 110.929 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 89.53 1.5 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 74.23 111.093 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 61.08 130.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 54.4 110.919 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.46 -26.14 35.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.122 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.49 32.3 1.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 51.14 111.095 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -105.04 78.49 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 64.33 111.087 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -144.11 -37.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.884 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m 55.51 167.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.878 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.885 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.471 -0.252 . . . . 73.32 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -129.08 78.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.902 0.382 . . . . 62.45 110.834 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.3 m -73.07 122.82 22.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.25 111.212 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.1 mtt -145.19 153.74 41.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 73.22 110.925 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -82.68 -47.63 11.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 62.15 111.164 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -102.5 94.28 5.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 72.44 110.908 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -123.91 95.0 4.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.461 . . . . 72.24 110.858 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.803 HG11 HD23 ' A' ' 34' ' ' LEU . 42.3 t -108.43 145.47 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.468 . . . . 74.13 111.108 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.803 HG12 ' HA ' ' A' ' 61' ' ' ARG . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.01 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.22 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.544 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 71.32 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 52.11 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.4 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.486 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 63.23 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 51.15 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 60.33 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 64.22 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.2 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 72.24 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.53 110.904 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.23 110.969 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 43.32 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 51.15 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.24 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.31 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.811 ' C ' HD22 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 71.11 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.847 HD21 ' CG ' ' A' ' 37' ' ' ASP . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.41 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.847 ' CG ' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 65.11 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 74.31 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.12 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.02 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.53 ' O ' HD12 ' A' ' 34' ' ' LEU . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.03 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 61.41 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.721 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.42 110.873 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.3 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.444 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.3 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.56 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 24' ' ' LEU . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.34 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.479 HG21 HD12 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 61.22 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.561 ' H ' HD12 ' A' ' 24' ' ' LEU . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.501 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.516 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 72.24 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 65.44 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.418 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 64.22 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 44.43 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.31 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.21 111.118 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.424 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.01 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.803 ' HA ' HG12 ' A' ' 10' ' ' VAL . 74.3 mtt180 -49.88 133.81 21.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 74.02 110.82 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -46.84 -78.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 73.52 110.889 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -146.6 39.74 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 54.14 110.911 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 64.0 m -86.04 -37.84 18.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 71.03 110.875 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -88.24 101.73 14.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.02 111.071 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 58.53 100.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.14 110.901 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.3 -32.81 39.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 75.51 111.091 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.05 -63.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 62.22 111.118 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.78 96.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 71.32 111.109 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.05 173.77 9.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.826 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.92 170.25 2.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.468 . . . . 72.44 110.924 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 72.35 110.839 -179.767 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.479 -0.248 . . . . 61.53 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.16 44.98 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 72.42 110.826 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.0 m -64.98 130.17 42.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 63.14 111.189 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.34 156.37 15.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 71.32 110.835 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.36 -60.82 2.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 53.33 111.096 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 44.14 40.68 3.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 63.21 110.859 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -94.88 150.52 20.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t -134.9 142.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 50.25 111.128 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.51 111.127 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.729 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 54.54 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.462 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.13 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 53.44 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 72.53 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.54 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 64.22 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.655 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.42 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 64.35 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.43 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 53.23 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.655 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.24 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.33 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.41 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.472 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 63.32 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.32 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.32 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.3 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.458 HD13 HG21 ' A' ' 44' ' ' VAL . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 53.23 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.42 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.478 HD21 ' HB3' ' A' ' 37' ' ' ASP . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 60.43 110.951 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.472 HD12 ' CG2' ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 61.52 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB3' HD21 ' A' ' 34' ' ' LEU . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.23 110.87 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 52.32 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 71.02 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.13 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.409 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.42 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.484 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 73.42 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.458 HG21 HD13 ' A' ' 32' ' ' LEU . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.13 111.094 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.13 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.31 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.52 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.427 ' OD1' ' C ' ' A' ' 49' ' ' ASN . 0.1 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.495 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.24 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 71.01 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 72.52 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 54.45 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.1 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 59' ' ' VAL . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.41 110.883 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.52 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.556 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 61.3 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 56' ' ' SER . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.35 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.2 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.729 ' HA ' HG12 ' A' ' 10' ' ' VAL . 14.3 ptm180 -56.29 144.07 31.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.31 110.937 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -48.98 -73.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.896 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 48.53 61.65 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 53.52 110.859 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 71.9 m -65.2 167.53 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.868 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.09 97.22 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 73.53 111.133 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -137.51 133.44 34.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 74.33 110.842 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.7 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 75.3 111.12 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -97.06 26.63 4.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 61.44 111.079 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.09 156.94 23.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 63.11 111.079 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -142.76 172.38 12.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 73.23 110.936 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 72' ' ' SER . 0.1 OUTLIER 61.09 84.37 0.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.868 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.831 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.484 -0.246 . . . . 72.21 112.484 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p 172.65 -31.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 74.01 110.764 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -74.72 138.56 42.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 62.21 111.177 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mtt -149.36 171.08 17.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 75.53 110.862 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.65 177.82 4.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 44.42 111.088 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -45.47 104.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.903 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -126.58 151.4 47.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 70.04 110.83 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t -118.97 147.29 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.515 . . . . 73.12 111.082 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.14 111.132 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 65.41 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.442 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.12 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.02 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 72.03 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.42 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 61.21 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.765 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.42 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.12 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.1 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.23 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.765 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 73.41 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.799 HD13 ' N ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.21 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.483 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.24 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 45.34 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 65.23 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 64.45 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.442 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.24 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HG21 ' A' ' 44' ' ' VAL . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.04 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.4 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 52.42 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.972 HD12 HG21 ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 71.4 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 74.53 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 34' ' ' LEU . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.05 110.929 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.23 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 63.32 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.14 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.23 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 74.55 110.905 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.14 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.565 HG21 HD13 ' A' ' 32' ' ' LEU . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.11 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.658 ' HB2' HD21 ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.13 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.546 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.11 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.972 HG21 HD12 ' A' ' 35' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.1 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.799 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.13 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 63.11 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.34 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.2 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 45.43 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.477 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 63.43 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.469 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 60.24 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.403 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 63.24 110.945 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.666 ' HA ' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.79 143.53 30.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 73.43 110.932 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -45.02 -93.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 62.42 110.92 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.481 ' O ' ' N ' ' A' ' 65' ' ' ALA . 4.3 p-10 -116.39 8.13 14.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.451 . . . . 72.12 110.927 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.8 m -55.67 82.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.31 110.915 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 63' ' ' ASN . . . -102.15 107.68 18.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.1 111.17 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -91.97 131.87 36.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 71.35 110.92 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.08 89.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 72.54 111.159 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.08 -59.28 3.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 62.13 111.068 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.97 107.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 63.42 111.098 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -150.72 162.25 41.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.13 110.883 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 m -128.09 170.55 12.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 73.23 110.839 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 40.03 110.899 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.436 -0.266 . . . . 64.12 112.436 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.94 86.95 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 62.32 110.88 -179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.8 m -74.59 139.7 43.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 62.02 111.103 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -44.49 148.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 73.14 110.857 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.07 98.44 5.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 64.45 111.098 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -158.92 39.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.34 110.868 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -142.09 176.27 9.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 71.24 110.86 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.4 t -121.13 146.71 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.226 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 74.41 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.15 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.12 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 61.33 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.44 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 64.3 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.13 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 72.21 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.43 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.44 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.34 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.35 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 74.35 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.52 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.929 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 61.32 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 54.41 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 64.33 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.53 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.851 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.35 110.828 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.35 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 37' ' ' ASP . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 74.13 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' CD1' HG21 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 43.43 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.474 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.44 110.843 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 44.23 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.41 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.03 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 72.14 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 71.1 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.492 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.422 ' HA ' HD12 ' A' ' 32' ' ' LEU . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 62.45 110.86 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 60.34 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 71.42 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 64.44 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.449 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.24 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.21 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.11 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 72.13 111.105 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.33 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 53.31 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 64.53 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.154 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.436 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.24 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.654 ' HA ' HG12 ' A' ' 10' ' ' VAL . 8.7 mtm180 -49.92 143.28 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.05 110.86 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -42.22 159.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 43.35 110.929 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.14 -24.34 8.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 60.41 110.888 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.6 t -54.24 -42.49 69.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 54.33 110.846 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.83 97.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 62.42 111.14 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.9 mtt180 51.45 100.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 70.22 110.83 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.19 69.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 64.54 111.134 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.79 -37.74 44.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 41.11 111.093 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -43.77 124.86 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.34 111.134 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' CG ' ' O ' ' A' ' 70' ' ' ASN . 22.1 p-10 -45.06 94.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.24 110.879 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.4 OUTLIER -103.63 6.15 36.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.779 -179.766 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.14 -0.482 . . . . 75.31 110.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.357 0 N-CA-C 112.492 -0.243 . . . . 73.21 112.492 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.37 88.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.934 0.397 . . . . 64.12 110.853 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.7 m -74.01 144.19 45.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 75.43 111.149 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.0 mtt -77.23 -49.39 15.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 71.2 110.845 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.43 155.58 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 74.14 111.062 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 61.32 91.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 75.03 110.885 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -163.0 137.24 6.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 72.2 110.887 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t -138.38 144.78 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 64.42 111.098 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 71.04 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 62.32 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 11' ' ' VAL . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.24 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.41 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.484 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.1 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 72.44 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.622 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 62.53 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.53 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 64.31 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 72.51 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.54 110.871 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.622 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 43.41 110.895 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.12 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.479 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.43 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.43 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.43 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.701 ' C ' HD22 ' A' ' 32' ' ' LEU . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.3 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 44.34 110.923 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.53 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.729 HD12 HG12 ' A' ' 44' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.595 HD12 HG21 ' A' ' 51' ' ' THR . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.954 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.02 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.594 ' HB3' HD21 ' A' ' 34' ' ' LEU . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 52.14 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.23 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.13 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.43 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.729 HG12 HD12 ' A' ' 34' ' ' LEU . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.35 111.105 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.695 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.44 110.883 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 71.11 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 42.4 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.24 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 64.12 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 62.21 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.595 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 60.4 111.203 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.54 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.23 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.34 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.24 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 65.55 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.498 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 70.01 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.43 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.21 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 10' ' ' VAL . 4.8 ptm180 -65.76 143.9 57.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.946 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' O ' ' CZ ' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -46.21 170.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 70.13 110.872 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -135.49 -33.92 0.86 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.51 110.905 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.9 m -76.22 83.67 3.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.12 110.854 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.09 81.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 73.4 111.028 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -144.81 157.74 44.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 75.2 110.861 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.4 79.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 44.12 111.117 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -52.92 -45.08 67.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 61.42 111.161 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -46.53 112.99 0.57 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 70.44 111.148 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' C ' ' A' ' 70' ' ' ASN . 28.5 t-20 -49.61 111.58 0.52 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 64.33 110.916 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 78.8 p -145.75 113.9 6.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 63.22 110.865 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 61.2 110.887 -179.788 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.42 -0.272 . . . . 74.33 112.42 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.4 m -112.48 84.85 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.914 0.388 . . . . 64.13 110.799 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' MET . 54.3 m -61.74 141.05 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 71.24 111.128 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.417 ' C ' ' O ' ' A' ' 3' ' ' THR . 5.7 mtm -37.06 153.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 52.13 110.928 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -71.08 -65.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.082 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 5' ' ' ALA . 22.2 tt0 36.39 50.94 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 73.41 110.866 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.08 -168.73 2.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 72.23 110.804 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.79 HG11 HD23 ' A' ' 34' ' ' LEU . 18.2 t -121.08 113.23 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.1 -0.5 . . . . 63.33 111.064 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 51.33 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.501 HG23 ' HB ' ' A' ' 59' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.54 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.419 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 73.35 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 21.52 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.23 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.15 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.11 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.32 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.23 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.4 mm100 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.01 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 53.54 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 62.24 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.04 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.491 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.33 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.536 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.45 110.946 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.419 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.13 110.879 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.21 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.465 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 62.55 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.1 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.23 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 61.24 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.419 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.23 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 45' ' ' ARG . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.947 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.79 HD23 HG11 ' A' ' 8' ' ' VAL . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.45 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.42 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.613 ' CG ' HD21 ' A' ' 34' ' ' LEU . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 71.41 110.791 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 53.1 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 71.35 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.45 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.449 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 61.5 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.45 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.599 ' O ' HD23 ' A' ' 32' ' ' LEU . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.904 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.22 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.15 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.2 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 61.11 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 72.23 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.23 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.02 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 54.34 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 64.2 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.501 ' HB ' HG23 ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 71.1 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.426 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -64.08 136.67 57.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.855 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 63' ' ' ASN . 3.4 ttpm? -60.55 -73.97 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 71.43 110.897 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' LYS . 0.5 OUTLIER 35.83 39.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 74.34 110.921 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.4 p -83.39 119.58 24.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 71.03 110.842 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.6 38.52 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 64.55 111.093 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.403 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -116.42 134.19 55.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 54.22 110.911 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -80.44 -33.19 37.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 53.25 111.039 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.81 -58.23 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 62.31 111.082 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.04 107.26 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 73.13 111.04 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.43 ' O ' ' C ' ' A' ' 71' ' ' SER . 38.4 p-10 -157.79 134.97 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 70.2 110.887 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.431 ' O ' ' C ' ' A' ' 72' ' ' SER . 68.5 p 35.24 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 63.32 110.823 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 71' ' ' SER . 35.0 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.87 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.443 -0.263 . . . . 70.34 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.28 -80.33 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 61.22 110.82 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.07 106.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.16 -0.473 . . . . 60.33 111.172 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttp -170.64 -42.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.237 -0.438 . . . . 74.42 110.904 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 131.92 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 72.53 111.087 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 93.44 4.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 75.33 110.836 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.37 176.67 7.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 63.24 110.901 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t -109.48 138.08 38.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 52.54 111.173 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 62.3 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.442 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.35 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 43.33 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' LYS . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 32.12 111.083 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.2 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.44 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.33 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.56 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.636 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 61.11 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 17' ' ' VAL . 2.0 mp0 -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.13 110.928 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 62.13 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.43 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.636 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.12 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 70.55 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.3 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.22 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.33 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 73.33 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.3 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.786 HD21 ' HB3' ' A' ' 37' ' ' ASP . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.911 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.915 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.786 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.53 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.32 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 54.02 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 61.31 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.528 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 72.3 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.34 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.52 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 53.45 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 63.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.575 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.41 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.33 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 71.02 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.21 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.507 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 64.45 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 63.31 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.13 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.442 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 72.44 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.51 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.74 143.5 30.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.11 110.909 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -53.39 132.49 39.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 72.02 110.955 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -105.92 33.67 3.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 65.03 110.902 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 89.0 p -87.36 84.55 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 40.23 110.853 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.49 -156.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 64.51 111.084 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.5 ttt85 -50.75 141.74 12.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 73.24 110.858 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.53 -52.55 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.04 111.093 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.66 55.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 64.41 111.148 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.12 143.15 57.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 55.33 111.052 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 m120 60.39 118.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 71.03 110.908 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.29 164.16 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 63.03 110.858 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 54.25 110.878 -179.798 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 112.53 -0.228 . . . . 62.11 112.53 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.5 p -163.92 76.98 0.37 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.92 0.39 . . . . 72.34 110.855 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.48 179.18 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 64.55 111.144 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.7 153.59 43.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.92 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.71 92.09 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 44.41 111.157 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -137.84 82.34 1.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 61.21 110.92 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -142.88 157.0 45.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.069 -0.514 . . . . 74.24 110.891 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t -127.06 141.98 44.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 54.23 111.057 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.43 111.101 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.855 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.544 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.1 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 43.44 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.58 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 71.12 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 73.2 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.31 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.576 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.03 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 63.02 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.769 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.04 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.15 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 72.03 110.886 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 72.11 110.869 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.416 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.24 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.769 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 63.22 110.949 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.13 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.22 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.11 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.21 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.409 ' HA ' HG12 ' A' ' 9' ' ' VAL . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.856 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.41 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 HG21 ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.44 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.812 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.52 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 51.54 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' HD11 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.43 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.581 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 63.11 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.504 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 64.1 110.87 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.609 ' HA ' HD12 ' A' ' 32' ' ' LEU . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.12 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.14 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 50.12 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.03 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 64.41 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 42' ' ' TRP . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 52.44 111.093 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.04 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 52.15 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.33 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.506 HG21 HG21 ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.21 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.33 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.547 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.8 ptp180 -52.77 144.16 14.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.873 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -106.55 151.4 25.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.41 110.904 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -99.47 31.56 3.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.93 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.3 t -70.53 -48.43 55.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 44.1 110.889 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.17 92.16 6.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.097 -0.501 . . . . 75.41 111.165 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -96.08 161.13 14.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 63.44 110.876 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.98 -50.05 64.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 64.13 111.17 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.77 36.11 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 64.33 111.148 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' C ' ' OD1' ' A' ' 70' ' ' ASN . . . -102.57 -46.58 4.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 72.4 111.1 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' A' ' 69' ' ' ALA . 3.1 m120 -150.3 -43.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.158 -0.474 . . . . 73.53 110.848 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 m -48.86 155.57 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 51.53 110.866 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 72.02 110.826 -179.797 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.446 -0.262 . . . . 63.14 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 p -129.11 -57.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.902 0.382 . . . . 53.31 110.799 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.17 158.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 74.42 111.13 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt -173.99 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 71.24 110.83 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.73 -71.47 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.214 -0.448 . . . . 51.11 111.079 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -172.67 132.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 74.54 110.928 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -130.69 110.52 11.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 74.52 110.882 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.525 HG11 HD23 ' A' ' 34' ' ' LEU . 24.9 t -131.64 145.43 35.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.157 -0.474 . . . . 61.52 111.098 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 70.24 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.876 HG12 ' HA ' ' A' ' 61' ' ' ARG . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 64.32 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.31 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 24.33 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 70.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.24 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.31 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 64.03 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.22 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.43 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.45 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 73.51 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.51 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.594 ' N ' HD12 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.1 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.482 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 34.52 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.482 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.41 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.41 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 64.13 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.464 HD13 HG21 ' A' ' 44' ' ' VAL . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.955 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 37' ' ' ASP . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.05 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 51' ' ' THR . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.833 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.33 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.41 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.55 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.03 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.464 HG21 HD13 ' A' ' 32' ' ' LEU . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.14 111.086 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 73.23 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 53.11 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.32 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.84 HG21 HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' N ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 51.13 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.11 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 63.12 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.14 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.33 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.14 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 64.32 111.176 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.457 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.876 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.2 mtt180 -50.9 143.99 9.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.13 110.849 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 63' ' ' ASN . 0.2 OUTLIER -84.1 148.58 26.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.829 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.407 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.0 m-80 -125.96 45.74 2.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 71.22 110.838 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.3 t -59.12 -50.11 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.53 110.822 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.55 -149.53 0.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 53.11 111.097 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 75.6 mtt180 -68.03 140.89 56.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 70.11 110.814 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.77 -16.68 29.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.48 . . . . 70.02 111.114 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -102.64 25.99 8.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 73.43 111.039 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.83 83.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.269 -0.423 . . . . 61.15 111.1 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -119.5 135.77 54.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.859 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.21 165.11 19.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 65.45 110.832 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.039 -0.528 . . . . 72.4 110.847 -179.859 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.439 -0.264 . . . . 74.35 112.439 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -77.07 -45.81 25.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.932 0.396 . . . . 62.52 110.91 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 38.5 m -56.67 137.24 54.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 74.52 111.162 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -124.73 -61.92 1.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 53.13 110.895 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.429 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -57.78 130.02 44.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 71.42 111.142 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' A' ' 5' ' ' ALA . 1.8 tt0 35.98 85.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 72.42 110.857 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -82.21 98.39 8.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 63.34 110.877 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t -129.68 142.57 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.24 111.141 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.12 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.583 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 71.45 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.575 HG23 ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.35 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.55 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.55 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.51 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 74.33 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.23 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.6 mm100 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 63.21 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 71.12 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 61.45 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.599 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.805 HD13 ' N ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.21 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.438 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.33 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.41 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.44 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HD2' HG23 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.12 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 51' ' ' THR . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.946 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.05 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 61.32 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.43 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 74.33 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.23 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.504 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.21 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 70.43 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.853 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.03 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.647 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.11 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 71.3 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.22 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.4 ' OD1' ' C ' ' A' ' 49' ' ' ASN . 0.1 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 64.34 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 35' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.14 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.805 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 64.33 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.33 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 54.41 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.504 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.12 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.53 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.31 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 61.23 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 43.44 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.413 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.52 139.07 39.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 71.31 110.837 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 179.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 70.44 110.873 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -122.74 41.17 3.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 62.11 110.861 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.6 t -87.72 -61.74 1.65 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 62.54 110.846 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.93 94.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 74.02 111.057 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 57.4 170.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.472 . . . . 73.12 110.891 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.34 -43.25 11.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 51.12 111.114 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -47.14 -55.65 8.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 32.1 111.123 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.49 151.93 3.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 65.51 111.164 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 59.61 102.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 75.02 110.83 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 72' ' ' SER . 1.6 t -108.09 99.49 8.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.827 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 71' ' ' SER . 34.5 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.3 110.81 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.233 . . . . 61.21 112.516 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 p -160.74 173.93 14.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.837 0.351 . . . . 71.12 110.914 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -45.96 118.96 2.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.174 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 ttm -167.82 -50.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 70.12 110.884 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.66 155.02 27.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 72.11 111.101 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 66.12 104.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 73.23 110.87 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -153.65 126.64 8.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.25 110.944 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.49 ' CG1' HD23 ' A' ' 34' ' ' LEU . 73.2 t -130.17 146.46 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 74.43 111.166 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.14 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' CA ' ' A' ' 61' ' ' ARG . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.41 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.414 HG22 ' N ' ' A' ' 12' ' ' ALA . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 63.23 111.126 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.414 ' N ' HG22 ' A' ' 11' ' ' VAL . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.11 111.018 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 72.5 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.49 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.12 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.12 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.597 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 64.2 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.02 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.21 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.35 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.597 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.82 HD13 ' N ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 74.44 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 54.32 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.42 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.2 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.02 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.697 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.931 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.832 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.22 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.44 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.833 HD11 ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.867 HD12 HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 64.22 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.833 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.31 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 32.34 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.24 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.524 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 74.42 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 73.51 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.446 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.54 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.832 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 54.22 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.673 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 71.04 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.551 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.44 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 65.31 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.867 HG21 HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.11 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.82 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.24 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.446 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.44 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.11 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.524 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.43 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 63.12 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 51.2 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.432 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.02 111.117 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.448 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.11 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CA ' HG12 ' A' ' 10' ' ' VAL . 8.7 ptm180 -54.63 142.56 27.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 70.55 110.901 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.45 ' HE3' ' CZ ' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -62.68 165.56 6.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.464 . . . . 73.42 110.956 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.1 43.23 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.424 . . . . 62.41 110.924 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 t -56.8 116.21 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 74.03 110.827 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.55 45.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 74.24 111.111 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -124.81 139.16 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 72.44 110.923 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.68 -20.03 28.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 62.44 111.116 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.01 29.97 5.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 63.12 111.083 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.53 132.02 8.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 71.14 111.118 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -51.99 122.76 8.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 75.35 110.907 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 89.3 p -133.88 82.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 64.3 110.886 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.11 110.92 -179.766 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.4 t . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.838 0.351 . . . . 75.42 111.115 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.087 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.84 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 61.34 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.44 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.13 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.43 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 64.5 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.33 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.33 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.3 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.52 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 62.22 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.33 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.12 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.887 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.886 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.41 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 72.05 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.52 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.13 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.24 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 74.4 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 73.33 110.958 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.31 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.784 HD21 ' HB3' ' A' ' 37' ' ' ASP . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.03 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.844 HD12 HG21 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 60.32 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.784 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.41 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.22 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 62.12 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.34 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.467 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.44 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.42 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 71.31 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.31 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.402 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.04 110.828 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.844 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 63.32 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 44.24 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 60.1 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.44 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.05 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 61.44 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.412 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 63.1 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.421 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.41 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.84 ' HA ' HG12 ' A' ' 10' ' ' VAL . 16.0 ptm180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.51 110.825 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.831 0.348 . . . . 64.44 111.14 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 64.44 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.722 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.13 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 70.41 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 63.03 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.44 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.51 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.53 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.507 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 53.31 110.907 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.01 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.1 110.869 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.15 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.24 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.11 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 73.14 110.923 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 51.22 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 65.5 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.34 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.485 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.45 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 52.2 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.3 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.828 HD12 HG21 ' A' ' 51' ' ' THR . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.43 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.3 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.528 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.52 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.03 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 71.23 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 72.23 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.14 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.03 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.427 HG21 HD13 ' A' ' 32' ' ' LEU . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.51 111.148 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 52.05 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 64.33 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 52.42 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.828 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.31 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.422 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 71.0 112.484 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 72.5 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 33.34 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 72.12 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.485 ' HA ' HG22 ' A' ' 59' ' ' VAL . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 62.43 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 56' ' ' SER . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.54 111.14 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.23 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.708 ' HA ' HG12 ' A' ' 10' ' ' VAL . 13.5 ptm180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 65.12 110.837 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.912 0.387 . . . . 62.31 111.135 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 73.11 111.133 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.47 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.33 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 71.54 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.457 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.457 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.53 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.01 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 55.43 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.04 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.11 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 51.03 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.11 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 64.44 110.816 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 64.35 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.44 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.481 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.31 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 72.11 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 52.33 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' HG12 ' A' ' 9' ' ' VAL . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 65.33 110.843 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' A' ' 37' ' ' ASP . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 54.44 110.878 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.503 HD12 ' CG2' ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.31 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.504 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 71.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.43 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.34 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.423 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.2 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.438 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.02 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.14 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 65.45 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.51 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.14 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 70.41 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.551 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.23 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.33 110.873 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 50.11 111.163 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.52 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.607 ' HA ' HG22 ' A' ' 59' ' ' VAL . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.895 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.05 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.475 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.607 HG22 ' HA ' ' A' ' 56' ' ' SER . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 55.44 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 65.42 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 54.12 110.882 -179.909 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.911 0.386 . . . . 65.2 111.131 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.23 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.677 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 54.53 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.494 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 61.33 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 61.01 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.514 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 70.12 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.514 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 71.44 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.45 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 63.55 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.04 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 50.22 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 60.13 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.44 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.42 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.11 110.94 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 63.34 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.475 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.446 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 71.32 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 64.23 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.22 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 73.42 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.721 HD12 HG12 ' A' ' 44' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.556 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 55.43 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.596 ' HB3' HD21 ' A' ' 34' ' ' LEU . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.824 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.3 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.24 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.45 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.14 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 73.55 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.721 HG12 HD12 ' A' ' 34' ' ' LEU . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 53.22 111.157 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.03 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 71.03 110.849 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 52.44 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 65.4 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 63.24 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.556 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 73.11 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 45.44 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.52 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 65.42 111.148 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.23 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.418 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 55.13 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.677 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.0 ptp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.845 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.851 0.358 . . . . 74.13 111.106 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.24 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.475 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 64.32 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 71.33 111.146 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.24 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 70.41 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.2 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.42 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 62.52 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 63.15 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.576 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 64.53 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.24 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.15 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.51 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.91 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.433 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.576 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.45 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 63.25 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.23 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.54 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.469 ' C ' HD22 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 64.34 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.603 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 65.11 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 65.04 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 54.43 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 51' ' ' THR . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 52.01 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.22 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 34' ' ' LEU . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.4 110.824 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.14 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.14 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.937 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.548 ' CE3' HD11 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.14 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 34' ' ' LEU . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 51.35 111.165 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 63.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.428 ' HA ' HD12 ' A' ' 32' ' ' LEU . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.01 110.942 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.24 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.552 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.22 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.15 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.633 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.12 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.3 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.32 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.15 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.21 112.365 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.42 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.11 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' HG21 ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.15 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 62.42 110.903 -179.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.454 ' CG1' ' HG2' ' A' ' 61' ' ' ARG . 70.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 74.24 111.154 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 54.34 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 61' ' ' ARG . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.3 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.1 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.35 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.04 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 70.1 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.01 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 51.12 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.55 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.536 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.89 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.49 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.96 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.54 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.45 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.11 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.45 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.918 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.54 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB3' ' A' ' 37' ' ' ASP . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.12 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 64.43 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.51 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.7 ' HB3' HD11 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.21 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.1 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 65.11 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.42 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.408 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.41 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.41 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.532 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.444 HG12 HD12 ' A' ' 34' ' ' LEU . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.13 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.487 ' O ' HD12 ' A' ' 32' ' ' LEU . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.645 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.869 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.436 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.31 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.1 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 71.21 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.43 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.11 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.43 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.4 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 64.31 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.45 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.438 ' HB ' HG23 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.51 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.435 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.586 ' HA ' HG12 ' A' ' 10' ' ' VAL . 27.2 mtm105 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.15 110.888 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.838 0.351 . . . . 45.21 111.154 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.55 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' ' 34' ' ' LEU . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 54.31 111.127 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 72.04 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.05 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.573 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.45 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 61.44 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.44 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.524 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 63.32 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.55 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.24 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.15 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.405 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 72.55 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 72.43 110.91 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 70.32 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 64.12 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.413 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 54.41 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.1 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 70.24 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.788 ' C ' HD22 ' A' ' 32' ' ' LEU . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 53.43 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.788 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 63.21 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 HG12 ' A' ' 44' ' ' VAL . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 71.23 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.572 ' HB3' HD21 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.22 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 70.34 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.52 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.421 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 65.15 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 55.13 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.22 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.581 HG12 HD12 ' A' ' 34' ' ' LEU . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 34.32 111.083 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.745 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 54.34 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.42 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.404 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.4 110.852 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.561 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.35 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.404 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.897 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.544 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.34 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.11 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 55.0 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.03 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 63.11 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.03 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.192 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.452 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.2 ptm180 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 62.44 110.907 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.4 HG11 HD23 ' A' ' 34' ' ' LEU . 94.8 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.935 0.398 . . . . 72.32 111.076 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.32 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG13 ' HB2' ' A' ' 34' ' ' LEU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.483 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.32 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 65.34 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.42 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.479 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.12 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 71.22 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.33 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.2 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 71.52 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.33 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.553 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.523 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.956 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.401 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.891 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 64.21 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.2 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.52 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.435 ' CD ' HD21 ' A' ' 32' ' ' LEU . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 43.14 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.31 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.642 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 45.32 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.02 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.637 HD21 ' OD2' ' A' ' 37' ' ' ASP . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.59 HD12 HG21 ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.42 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.21 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' HD21 ' A' ' 34' ' ' LEU . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 73.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.13 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.32 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 65.21 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.25 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.471 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.628 HG12 HD12 ' A' ' 34' ' ' LEU . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 64.21 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.426 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.912 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 53.13 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.458 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.2 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 50.21 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.31 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.59 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.24 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.14 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.3 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 42' ' ' TRP . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.14 111.126 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.12 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 33.31 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.405 ' HB ' HG23 ' A' ' 10' ' ' VAL . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 63.43 111.167 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.43 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.55 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.523 ' HA ' HG12 ' A' ' 10' ' ' VAL . 10.9 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.864 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.867 0.365 . . . . 74.44 111.096 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 41.43 111.115 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.585 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 65.3 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.489 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.412 ' HB1' HD12 ' A' ' 26' ' ' ILE . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.31 111.042 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.4 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.22 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.526 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 54.34 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.646 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.35 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.32 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.44 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.21 110.944 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.646 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.01 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.47 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 54.25 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 71.33 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.22 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 64.23 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 52.5 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.489 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 73.22 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.3 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 61.11 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 51' ' ' THR . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 62.34 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.506 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.21 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 72.01 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.4 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 42.41 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.493 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 72.22 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.506 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.537 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.5 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.51 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.04 110.86 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.634 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.929 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.42 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 55.21 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 51.53 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.49 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.12 111.158 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.34 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 73.13 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.12 111.112 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.531 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.33 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.23 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.3 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.531 ' CD1' ' HG2' ' A' ' 55' ' ' PRO . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 60.2 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.407 ' HB ' HG23 ' A' ' 10' ' ' VAL . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 53.02 111.118 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 70.22 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 ptm180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 52.35 110.872 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.803 HG11 HD23 ' A' ' 34' ' ' LEU . 42.3 t . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.888 0.375 . . . . 74.13 111.108 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.803 HG12 ' HA ' ' A' ' 61' ' ' ARG . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.01 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.22 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.544 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 71.32 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 52.11 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.4 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.486 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 63.23 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 51.15 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 60.33 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 64.22 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.2 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 72.24 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.53 110.904 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.23 110.969 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 43.32 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 51.15 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.24 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.31 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.811 ' C ' HD22 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 71.11 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.847 HD21 ' CG ' ' A' ' 37' ' ' ASP . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.41 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.847 ' CG ' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 65.11 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 74.31 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.12 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.02 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.53 ' O ' HD12 ' A' ' 34' ' ' LEU . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.03 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 61.41 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.721 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.42 110.873 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.3 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.444 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.3 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.56 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 24' ' ' LEU . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.34 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.479 HG21 HD12 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 61.22 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.561 ' H ' HD12 ' A' ' 24' ' ' LEU . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.501 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.516 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 72.24 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 65.44 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.418 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 64.22 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 44.43 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.31 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.21 111.118 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.424 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.01 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.803 ' HA ' HG12 ' A' ' 10' ' ' VAL . 74.3 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 74.02 110.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.885 0.374 . . . . 50.25 111.128 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.51 111.127 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.729 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 54.54 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.462 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.13 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 53.44 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 72.53 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.54 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 64.22 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.655 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.42 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 64.35 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.43 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 53.23 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.655 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.24 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.33 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.41 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.472 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 63.32 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.32 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.32 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.3 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.458 HD13 HG21 ' A' ' 44' ' ' VAL . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 53.23 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.42 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.478 HD21 ' HB3' ' A' ' 37' ' ' ASP . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 60.43 110.951 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.472 HD12 ' CG2' ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 61.52 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB3' HD21 ' A' ' 34' ' ' LEU . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.23 110.87 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 52.32 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 71.02 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.13 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.409 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.42 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.484 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 73.42 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.458 HG21 HD13 ' A' ' 32' ' ' LEU . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.13 111.094 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.13 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.31 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.52 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.577 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.495 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.24 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 71.01 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 72.52 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 54.45 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.1 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 59' ' ' VAL . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.41 110.883 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.52 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.556 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 61.3 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 56' ' ' SER . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.35 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.2 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.729 ' HA ' HG12 ' A' ' 10' ' ' VAL . 14.3 ptm180 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.31 110.937 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.872 0.368 . . . . 73.12 111.082 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.14 111.132 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 65.41 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.442 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.12 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.02 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 72.03 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.42 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 61.21 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.765 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.42 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.12 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.1 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.23 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.765 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 73.41 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.799 HD13 ' N ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.21 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.483 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.24 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 45.34 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 65.23 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 64.45 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.442 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.24 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HG21 ' A' ' 44' ' ' VAL . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.04 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.4 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 52.42 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.972 HD12 HG21 ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 71.4 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 74.53 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 34' ' ' LEU . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.05 110.929 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.23 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 63.32 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.14 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.23 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 74.55 110.905 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.14 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.565 HG21 HD13 ' A' ' 32' ' ' LEU . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.11 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.658 ' HB2' HD21 ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.13 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.546 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.11 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.972 HG21 HD12 ' A' ' 35' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.1 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.799 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.13 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 63.11 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.34 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.2 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 45.43 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.477 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 63.43 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.469 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 60.24 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.403 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 63.24 110.945 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.666 ' HA ' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 73.43 110.932 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.4 t . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.849 0.357 . . . . 75.25 111.226 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 74.41 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.15 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.12 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 61.33 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.44 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 64.3 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.13 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 72.21 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.43 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.44 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.34 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.35 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 74.35 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.52 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.929 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 61.32 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 54.41 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 64.33 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.53 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.851 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.35 110.828 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.35 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 37' ' ' ASP . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 74.13 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' CD1' HG21 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 43.43 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.474 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.44 110.843 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 44.23 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.41 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.03 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 72.14 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 71.1 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.492 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.422 ' HA ' HD12 ' A' ' 32' ' ' LEU . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 62.45 110.86 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 60.34 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 71.42 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 64.44 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.449 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.24 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.21 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.11 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 72.13 111.105 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.33 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 53.31 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 64.53 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.154 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.436 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.24 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.654 ' HA ' HG12 ' A' ' 10' ' ' VAL . 8.7 mtm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.05 110.86 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.841 0.353 . . . . 64.42 111.098 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 71.04 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 62.32 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 11' ' ' VAL . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.24 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.41 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.484 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.1 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 72.44 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.622 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 62.53 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.53 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 64.31 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 72.51 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.54 110.871 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.622 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 43.41 110.895 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.12 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.479 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.43 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.43 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.43 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.701 ' C ' HD22 ' A' ' 32' ' ' LEU . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.3 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 44.34 110.923 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.53 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.729 HD12 HG12 ' A' ' 44' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.595 HD12 HG21 ' A' ' 51' ' ' THR . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.954 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.02 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.594 ' HB3' HD21 ' A' ' 34' ' ' LEU . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 52.14 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.23 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.13 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.43 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.729 HG12 HD12 ' A' ' 34' ' ' LEU . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.35 111.105 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.695 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.44 110.883 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 71.11 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 42.4 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.24 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 64.12 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 62.21 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.595 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 60.4 111.203 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.54 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.23 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.34 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.24 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 65.55 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.498 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 70.01 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.43 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.21 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 10' ' ' VAL . 4.8 ptm180 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.946 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.79 HG11 HD23 ' A' ' 34' ' ' LEU . 18.2 t . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.855 0.359 . . . . 63.33 111.064 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 51.33 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.501 HG23 ' HB ' ' A' ' 59' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.54 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.419 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 73.35 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 21.52 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.23 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.15 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.11 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.32 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.23 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.1 mm-40 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.01 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 53.54 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 62.24 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.04 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.491 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.33 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.536 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.45 110.946 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.419 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.13 110.879 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.21 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.465 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 62.55 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.1 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.23 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 61.24 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.419 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.23 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 45' ' ' ARG . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.947 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.79 HD23 HG11 ' A' ' 8' ' ' VAL . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.45 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.42 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.613 ' CG ' HD21 ' A' ' 34' ' ' LEU . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 71.41 110.791 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 53.1 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 71.35 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.45 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.449 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 61.5 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.45 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.599 ' O ' HD23 ' A' ' 32' ' ' LEU . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.904 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.22 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.15 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.2 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 61.11 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 72.23 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.23 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.02 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 54.34 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 64.2 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.501 ' HB ' HG23 ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 71.1 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.426 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.855 -179.902 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.819 0.342 . . . . 52.54 111.173 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 62.3 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.442 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.35 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 43.33 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' LYS . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 32.12 111.083 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.2 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.44 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.33 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.56 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.636 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 61.11 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.3 OUTLIER -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.13 110.928 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 62.13 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.43 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.636 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.12 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 70.55 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.3 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.22 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.33 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 73.33 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.3 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.786 HD21 ' HB3' ' A' ' 37' ' ' ASP . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.911 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.915 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.786 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.53 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.32 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 54.02 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 61.31 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.528 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 72.3 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.34 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.52 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 53.45 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 63.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.575 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.41 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.33 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 71.02 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.21 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.507 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 64.45 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 63.31 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.13 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.442 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 72.44 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.51 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.11 110.909 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.921 0.391 . . . . 54.23 111.057 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.43 111.101 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.855 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.544 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.1 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 43.44 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.58 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 71.12 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 73.2 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.31 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.576 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.03 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 63.02 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.769 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.04 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.15 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 72.03 110.886 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 72.11 110.869 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.416 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.24 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.769 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 63.22 110.949 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.13 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.22 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.11 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.21 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.409 ' HA ' HG12 ' A' ' 9' ' ' VAL . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.856 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.41 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 HG21 ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.44 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.812 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.52 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 51.54 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' HD11 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.43 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.581 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 63.11 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.504 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 64.1 110.87 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.609 ' HA ' HD12 ' A' ' 32' ' ' LEU . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.12 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.14 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 50.12 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.03 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 64.41 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 42' ' ' TRP . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 52.44 111.093 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.04 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 52.15 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.33 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.506 HG21 HG21 ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.21 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.33 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.547 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.8 ptp180 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.873 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.525 HG11 HD23 ' A' ' 34' ' ' LEU . 24.9 t . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.911 0.386 . . . . 61.52 111.098 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 70.24 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.876 HG12 ' HA ' ' A' ' 61' ' ' ARG . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 64.32 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.31 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 24.33 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 70.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.24 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.31 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 64.03 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.22 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.43 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.45 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 73.51 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.51 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.594 ' N ' HD12 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.1 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.482 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 34.52 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.482 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.41 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.41 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 64.13 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.464 HD13 HG21 ' A' ' 44' ' ' VAL . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.955 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 37' ' ' ASP . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.05 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 51' ' ' THR . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.833 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.33 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.41 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.55 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.03 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.464 HG21 HD13 ' A' ' 32' ' ' LEU . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.14 111.086 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 73.23 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 53.11 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.32 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.573 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.84 HG21 HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' N ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 51.13 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.11 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 63.12 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.14 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.33 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.14 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 64.32 111.176 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.457 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.876 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.2 mtt180 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.13 110.849 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.866 0.365 . . . . 71.24 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.12 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.583 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 71.45 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.575 HG23 ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.35 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.55 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.55 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.51 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 74.33 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.23 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.3 mm-40 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 63.21 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 71.12 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 61.45 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.599 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.805 HD13 ' N ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.21 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.438 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.33 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.41 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.44 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HD2' HG23 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.12 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 51' ' ' THR . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.946 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.05 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 61.32 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.43 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 74.33 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.23 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.504 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.21 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 70.43 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.853 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.03 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.647 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.11 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 71.3 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.22 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 64.34 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 35' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.14 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.805 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 64.33 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.33 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 54.41 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.504 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.12 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.53 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.31 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 61.23 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 43.44 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.413 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 71.31 110.837 -179.897 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.49 ' CG1' HD23 ' A' ' 34' ' ' LEU . 73.2 t . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.829 0.347 . . . . 74.43 111.166 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.14 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' CA ' ' A' ' 61' ' ' ARG . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.41 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.414 HG22 ' N ' ' A' ' 12' ' ' ALA . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 63.23 111.126 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.414 ' N ' HG22 ' A' ' 11' ' ' VAL . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.11 111.018 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 72.5 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.49 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.12 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.12 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.597 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 64.2 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.02 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.21 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.35 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.597 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.82 HD13 ' N ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 74.44 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 54.32 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.42 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.2 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.02 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.697 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.931 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.832 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.22 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.44 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.833 HD11 ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.867 HD12 HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 64.22 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.833 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.31 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 32.34 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.24 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.524 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 74.42 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 73.51 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.446 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.54 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.832 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 54.22 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.673 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 71.04 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.551 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.44 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 65.31 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.867 HG21 HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.11 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.82 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.24 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.446 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.44 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.11 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.524 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.43 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 63.12 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 51.2 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.432 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.02 111.117 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.448 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.11 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CA ' HG12 ' A' ' 10' ' ' VAL . 8.7 ptm180 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 70.55 110.901 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 43.21 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m -156.87 83.87 0.95 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.855 0.36 . . . . 73.01 110.893 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.3 m -77.2 115.55 17.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 62.11 111.138 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm 67.79 148.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.888 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.74 82.33 5.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 70.41 111.095 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -156.76 90.9 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.297 -0.411 . . . . 74.5 110.855 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -140.3 38.45 1.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 72.4 110.844 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.4 t -149.12 125.27 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 75.42 111.115 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -126.37 144.27 37.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 74.41 111.087 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.84 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.4 m -129.5 143.65 40.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.13 -0.486 . . . . 61.34 111.058 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -102.84 144.02 14.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 74.44 111.137 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.37 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 75.13 111.134 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -96.0 -32.96 12.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 74.43 110.908 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -125.25 -173.94 2.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.877 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -106.62 146.57 30.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.46 . . . . 64.5 110.932 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.561 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.3 t80 -149.09 148.86 30.18 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 74.33 110.953 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 94.8 t -110.21 107.89 24.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.33 111.138 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.561 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -42.69 90.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 74.3 111.116 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -41.58 -66.89 0.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 64.52 110.944 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -80.26 154.08 28.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 62.22 110.892 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -63.31 -19.47 64.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.232 -0.44 . . . . 65.33 110.826 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -79.09 -29.54 43.37 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.211 -0.449 . . . . 53.12 110.981 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 61.0 mt-10 -73.8 159.28 33.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.887 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.546 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -109.35 138.35 45.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.886 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -73.56 143.42 46.46 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.182 -0.463 . . . . 62.41 110.862 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.8 pt -118.04 178.93 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 74.43 111.102 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -152.08 144.34 23.98 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 72.05 110.917 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 10.9 ttpt -56.74 117.75 4.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 75.52 110.919 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER 79.42 35.5 0.17 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.24 -0.437 . . . . 75.13 110.885 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.479 ' OE1' ' ND2' ' A' ' 46' ' ' ASN . 2.1 tt0 -111.36 125.59 54.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 72.24 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.9 mmm-85 -86.49 109.2 18.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 74.4 110.876 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 32' ' ' LEU . 2.8 mm? -103.03 138.89 39.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 73.33 110.958 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.7 m-90 -86.42 114.9 23.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.31 110.951 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.784 HD21 ' HB3' ' A' ' 37' ' ' ASP . 20.5 tp -72.39 124.35 24.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 73.03 110.936 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.844 HD12 HG21 ' A' ' 51' ' ' THR . 18.2 mt -103.14 -60.17 1.6 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.897 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.54 112.43 17.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 60.32 110.866 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.784 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -117.99 47.08 1.64 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 64.41 110.868 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.77 -44.56 4.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.5 110.914 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.6 mmmt -77.21 156.69 31.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.145 -0.48 . . . . 74.22 110.91 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.425 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.1 m -35.66 -45.78 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 62.12 110.891 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.428 ' O ' ' CD1' ' A' ' 53' ' ' PHE . 26.3 m95 -90.43 133.01 35.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.155 -0.475 . . . . 74.52 110.927 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 16.7 m0 -85.25 114.02 22.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.261 -0.427 . . . . 74.34 110.921 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.467 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 31.0 ttt180 -79.45 124.47 28.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.214 -0.448 . . . . 72.44 110.833 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.4 m -128.56 172.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 71.42 111.135 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.0 ttp180 -122.5 150.97 41.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.469 . . . . 71.31 110.848 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.479 ' ND2' ' OE1' ' A' ' 30' ' ' GLU . 8.9 t-20 -110.11 164.22 12.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 63.31 110.879 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 52.4 p -59.35 -18.01 34.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 74.35 110.831 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.402 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -83.3 9.6 10.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 71.04 110.828 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.548 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.96 -3.28 2.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.22 110.929 -179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 7.7 mtpt -76.95 156.0 32.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 75.11 110.93 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.844 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.55 153.85 47.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.433 . . . . 63.32 111.125 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.04 169.63 42.68 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.715 -0.755 . . . . 44.24 112.44 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.467 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.8 m-85 -91.75 128.95 37.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.85 0.357 . . . . 60.1 110.914 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.4 m -136.28 150.21 70.17 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.623 0.725 . . . . 72.44 111.096 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 156.79 62.54 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.628 2.218 . . . . 75.05 112.352 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.6 p -89.94 35.54 0.85 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.255 -0.43 . . . . 75.0 110.893 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 -105.8 -33.77 7.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 61.44 110.91 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -107.45 25.28 11.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 71.33 110.917 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.412 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.9 m -150.87 169.51 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.139 -0.482 . . . . 63.1 111.094 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.421 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 3.3 tt0 -163.9 131.31 3.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 75.41 110.924 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.84 ' HA ' HG12 ' A' ' 10' ' ' VAL . 16.0 ptm180 -63.18 142.48 58.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 73.51 110.825 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.445 ' O ' ' CB ' ' A' ' 63' ' ' ASN . 0.1 OUTLIER -109.4 -166.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.493 . . . . 64.54 110.889 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.445 ' CB ' ' O ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER 79.04 25.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 73.33 110.924 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 61.3 p -62.32 173.73 1.11 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.124 -0.489 . . . . 45.23 110.888 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.25 -157.04 0.62 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.1 111.079 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 mtt180 -45.35 142.6 2.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.33 110.844 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -62.42 -49.26 76.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.457 . . . . 64.35 111.034 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -55.33 -58.23 8.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.54 111.081 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.82 120.76 26.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 51.34 111.105 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 71' ' ' SER . 6.7 p-10 -123.82 84.9 2.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.443 . . . . 74.23 110.93 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 70' ' ' ASN . 1.8 t 35.47 83.04 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.3 110.889 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 70.42 110.889 -179.735 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.495 -0.242 . . . . 51.43 112.495 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.17 132.38 45.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.981 0.419 . . . . 62.53 110.84 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -91.25 163.3 14.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 61.43 111.176 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.3 mtm -84.73 138.1 32.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.278 -0.419 . . . . 72.5 110.869 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.79 176.78 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 62.01 111.092 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 57.29 106.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 62.44 110.857 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -123.96 85.21 2.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 53.41 110.844 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.5 t -108.78 146.22 14.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 64.44 111.14 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.93 140.73 48.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 64.44 111.161 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.722 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.2 m -132.58 138.91 51.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 72.13 111.146 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.465 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.2 p -109.2 130.38 62.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 70.41 111.096 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.68 144.46 49.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.133 -0.485 . . . . 63.03 111.145 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.0 mtpt -99.11 -32.59 11.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.226 -0.443 . . . . 75.44 110.965 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.449 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 35.0 m-85 -128.07 -177.75 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.871 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.37 140.09 33.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.043 -0.526 . . . . 72.51 110.812 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.8 t80 -143.29 148.97 37.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.92 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -112.25 108.89 26.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 64.53 111.088 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.507 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -47.17 88.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 74.0 111.085 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -42.98 -65.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 53.31 110.907 -179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -79.81 146.78 32.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.962 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -58.12 -21.92 48.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 72.01 110.871 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -75.23 -32.03 61.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.461 . . . . 65.02 110.913 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.499 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 78.4 mt-10 -72.2 163.01 28.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.217 -0.447 . . . . 73.1 110.869 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.5 OUTLIER -111.63 140.83 45.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 72.15 110.897 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.69 139.93 40.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.471 . . . . 73.24 110.831 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -117.98 177.89 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.205 -0.452 . . . . 62.11 111.09 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -152.09 141.44 21.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.143 -0.48 . . . . 73.14 110.923 179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -53.27 119.53 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 51.22 110.873 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 74.68 40.45 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 65.5 110.867 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.29 110.3 16.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.34 110.83 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.485 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -66.76 147.07 53.74 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.172 -0.467 . . . . 74.45 110.918 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' CD2' ' O ' ' A' ' 45' ' ' ARG . 21.0 mt -143.17 158.33 43.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 52.2 110.899 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.2 m-90 -97.91 114.41 26.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.186 -0.461 . . . . 75.3 110.928 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.722 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.5 OUTLIER -73.77 129.23 37.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.228 -0.442 . . . . 70.21 110.895 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.828 HD12 HG21 ' A' ' 51' ' ' THR . 68.5 mt -108.98 -37.68 5.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 73.43 110.898 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.26 111.02 5.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 73.3 110.87 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.528 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 1.3 p30 -118.01 35.88 4.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 62.52 110.922 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.13 -45.02 4.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 73.03 110.85 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -73.05 153.8 40.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 71.23 110.846 -179.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -34.51 -51.48 0.47 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.854 -179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -91.24 123.05 34.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 72.23 110.937 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.528 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.2 m0 -78.12 110.31 12.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 75.14 110.892 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.487 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.6 ttm180 -79.75 125.77 30.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 74.03 110.881 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.427 HG21 HD13 ' A' ' 32' ' ' LEU . 14.4 m -130.35 169.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.215 -0.448 . . . . 74.51 111.148 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.468 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 11.5 ttp180 -116.32 157.63 24.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 75.14 110.822 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 47' ' ' SER . 10.9 t-20 -114.74 163.72 15.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 52.05 110.891 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.434 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 73.3 p -59.35 -20.03 51.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.863 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.87 9.89 7.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.133 -0.485 . . . . 64.33 110.847 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.59 -4.55 2.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.199 -0.455 . . . . 52.42 110.853 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -76.71 166.12 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 73.41 110.9 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.828 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -145.97 150.4 35.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.254 -0.43 . . . . 72.31 111.183 179.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.422 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -166.97 161.09 34.94 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.729 -0.748 . . . . 71.0 112.484 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.487 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 13.2 m-85 -85.53 135.85 33.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.951 0.405 . . . . 72.5 110.843 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -145.55 150.88 45.31 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.597 0.713 . . . . 33.34 111.135 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 130.92 20.27 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 72.12 112.384 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.485 ' HA ' HG22 ' A' ' 59' ' ' VAL . 58.8 p -62.57 -10.11 11.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.796 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -70.28 -19.94 63.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 62.43 110.857 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -101.4 -28.13 12.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.214 -0.448 . . . . 75.5 110.949 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG22 ' HA ' ' A' ' 56' ' ' SER . 13.7 m -111.15 175.32 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 71.54 111.14 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.05 130.5 3.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.249 -0.432 . . . . 75.23 110.922 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.708 ' HA ' HG12 ' A' ' 10' ' ' VAL . 13.5 ptm180 -67.03 143.83 56.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 65.12 110.837 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.15 162.06 1.12 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.438 . . . . 63.23 110.961 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -136.15 35.1 2.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 74.41 110.87 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 52.3 m -58.9 85.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.113 -0.494 . . . . 64.34 110.872 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.9 88.15 2.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 72.22 111.054 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 60.92 128.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 73.04 110.917 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.65 -50.66 72.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 75.45 111.065 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.5 -43.27 62.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.217 -0.447 . . . . 73.02 111.093 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -99.95 94.12 6.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.24 -0.437 . . . . 63.14 111.15 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.442 ' CG ' ' O ' ' A' ' 70' ' ' ASN . 0.7 OUTLIER -178.7 117.87 0.07 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.898 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.4 p 59.85 120.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 72.14 110.847 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 64.33 110.863 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.555 -0.218 . . . . 75.44 112.555 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m 39.57 50.97 2.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 74.33 110.82 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 81.8 m -53.58 114.87 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 70.02 111.114 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.6 ttt -125.12 177.59 6.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.168 -0.469 . . . . 71.14 110.882 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.94 177.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.27 -0.423 . . . . 61.25 111.142 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 61.4 mt-10 -101.4 112.11 24.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 51.23 110.871 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -104.71 -175.86 2.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 74.52 110.875 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -116.56 142.65 29.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 62.31 111.135 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.436 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -128.61 140.93 47.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 73.11 111.133 179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.47 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 1.9 m -126.93 144.05 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 72.33 111.185 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.485 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -114.27 119.47 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.455 . . . . 71.54 111.091 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.86 142.91 57.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 74.14 111.133 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.457 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 10.3 mtpt -95.94 -37.81 10.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.438 . . . . 72.43 110.887 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.457 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 26.3 m-85 -123.78 -176.78 3.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 63.32 110.852 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -97.85 137.26 36.97 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.128 -0.487 . . . . 61.53 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.9 t80 -138.82 149.14 44.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 74.01 110.852 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -113.65 109.04 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.05 -0.523 . . . . 55.43 111.19 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.558 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -42.35 91.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 73.04 111.124 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.489 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.0 OUTLIER -42.99 -66.63 0.35 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.263 -0.426 . . . . 73.11 110.938 -179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -82.79 153.32 25.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.944 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -61.01 -20.58 62.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.167 -0.47 . . . . 51.03 110.904 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -77.11 -37.41 54.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 73.11 110.899 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.51 166.89 9.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 64.44 110.816 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -112.89 148.94 33.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 64.35 110.953 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -85.91 138.3 32.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.24 -0.437 . . . . 73.44 110.874 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.481 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -118.02 179.05 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 73.31 111.117 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.422 ' N ' HG13 ' A' ' 26' ' ' ILE . 2.6 tptt -152.03 141.71 21.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.233 -0.439 . . . . 72.11 110.879 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.0 118.96 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 74.25 110.903 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.12 41.74 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 52.33 110.855 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -122.87 112.05 17.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 73.33 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -67.0 145.69 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.153 -0.476 . . . . 73.41 110.845 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' O ' HG12 ' A' ' 9' ' ' VAL . 18.5 mt -141.56 162.46 35.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 65.33 110.843 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.55 118.84 37.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.887 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.504 HD21 ' HB3' ' A' ' 37' ' ' ASP . 15.3 tp -80.11 130.21 35.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 54.44 110.878 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.503 HD12 ' CG2' ' A' ' 51' ' ' THR . 49.1 mt -111.83 -64.63 1.26 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.217 -0.447 . . . . 74.2 110.969 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.71 110.98 18.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.19 -0.459 . . . . 61.31 110.842 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.504 ' HB3' HD21 ' A' ' 34' ' ' LEU . 9.6 p-10 -118.03 29.66 7.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 71.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.18 -45.0 7.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 75.43 110.896 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.441 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -74.37 151.59 39.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.08 -0.509 . . . . 73.34 110.916 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.441 ' C ' ' O ' ' A' ' 39' ' ' LYS . 40.3 m -34.44 -49.5 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.204 -0.453 . . . . 74.25 110.802 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.423 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.0 m95 -86.0 125.53 33.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.149 -0.478 . . . . 75.2 110.902 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.438 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 6.3 m0 -81.3 109.49 15.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.242 -0.435 . . . . 73.02 110.873 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.5 ttt180 -79.09 129.28 34.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.267 -0.424 . . . . 73.14 110.815 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -130.44 171.97 16.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.161 -0.472 . . . . 65.45 111.124 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -122.18 150.36 42.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 75.23 110.838 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -108.73 166.98 10.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.812 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.8 p -61.54 -21.43 64.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.5 . . . . 60.32 110.843 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 3.0 mmt -79.19 8.68 5.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 72.51 110.881 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.29 -3.86 2.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.27 -0.423 . . . . 70.14 110.837 -179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -76.23 166.06 23.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 70.41 110.898 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.551 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -144.13 157.35 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.226 -0.443 . . . . 70.23 111.167 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -174.54 160.72 30.23 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 52.32 112.491 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -87.42 141.33 28.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.934 0.397 . . . . 75.33 110.873 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.3 m -151.14 150.83 28.24 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.64 0.733 . . . . 50.11 111.163 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.79 122.18 8.85 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.739 2.293 . . . . 54.52 112.322 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.607 ' HA ' HG22 ' A' ' 59' ' ' VAL . 85.5 p -54.41 -14.78 1.33 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.895 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -67.72 -11.39 58.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.102 -0.499 . . . . 73.05 110.884 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.475 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 15.1 m-85 -107.8 -23.27 12.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.178 -0.465 . . . . 61.23 110.935 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.607 HG22 ' HA ' ' A' ' 56' ' ' SER . 14.2 m -114.67 174.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.108 -0.496 . . . . 55.44 111.181 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -163.76 132.74 3.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 65.42 110.907 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -63.34 143.13 58.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 54.12 110.882 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.1 165.2 0.52 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 74.1 110.918 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -171.45 38.15 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.868 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 23.6 m -74.34 85.07 1.95 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.187 -0.46 . . . . 73.11 110.837 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.4 77.44 7.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.131 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 64.06 120.19 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.169 -0.469 . . . . 71.42 110.887 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.16 -50.11 62.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.462 . . . . 74.34 111.122 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -83.66 35.55 0.51 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.458 . . . . 44.42 111.131 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.02 -48.04 11.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.463 . . . . 74.02 111.126 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -110.76 177.35 4.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.275 -0.42 . . . . 73.43 110.893 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 72' ' ' SER . 3.9 m -76.43 80.96 3.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 54.23 110.924 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.404 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.122 -0.49 . . . . 71.23 110.919 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.474 -0.25 . . . . 74.45 112.474 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.94 96.93 4.92 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.936 0.398 . . . . 61.22 110.858 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 88.0 m -38.04 -61.7 0.63 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.058 -0.519 . . . . 64.23 111.165 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt 67.75 136.68 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.257 -0.429 . . . . 63.4 110.896 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.49 129.87 43.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.3 -0.409 . . . . 74.1 111.12 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 64.2 161.33 0.11 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.884 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -168.21 129.38 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 62.15 110.943 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.8 t -133.21 149.03 31.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 65.2 111.131 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.06 141.73 45.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.123 -0.489 . . . . 74.23 111.134 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.677 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.2 m -129.82 138.56 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 54.53 111.076 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.494 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 7.5 p -105.65 120.59 56.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.127 -0.488 . . . . 61.33 111.113 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.61 141.39 58.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 61.01 111.145 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.514 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 16.3 ptmt -107.38 -14.65 14.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 70.12 110.88 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.514 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 23.8 m-85 -139.22 -179.1 5.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 71.44 110.882 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -103.46 138.42 40.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 63.45 110.818 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.547 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 7.2 t80 -143.6 148.99 36.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.17 -0.468 . . . . 63.55 110.897 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.0 t -114.53 109.63 29.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 70.04 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.53 89.68 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 50.22 111.105 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -45.12 -66.49 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.964 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.34 151.36 41.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.184 -0.462 . . . . 75.35 110.882 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.2 -12.75 43.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 60.13 110.91 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -86.1 -35.69 20.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 75.44 110.914 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.547 ' OE2' ' CH2' ' A' ' 41' ' ' TRP . 82.5 mt-10 -66.53 161.63 22.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 62.42 110.858 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.6 OUTLIER -107.14 152.12 24.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 65.11 110.94 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -88.11 137.42 32.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 63.34 110.843 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.475 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -118.61 179.15 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 74.5 111.093 -179.972 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.446 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.2 tppt? -152.07 141.01 21.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 75.51 110.814 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 7.8 tttm -50.8 115.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.445 . . . . 71.32 110.921 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.416 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER 77.32 41.44 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.16 -0.473 . . . . 64.23 110.888 -179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -114.07 122.53 47.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.22 110.889 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.2 OUTLIER -82.43 122.33 27.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 110.908 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.5 mm? -120.12 164.51 16.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.228 -0.442 . . . . 74.22 110.953 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.4 m-90 -101.7 110.85 22.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.229 -0.441 . . . . 73.42 110.927 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.721 HD12 HG12 ' A' ' 44' ' ' VAL . 18.2 tp -72.28 124.22 24.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.871 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.556 HD12 ' CG2' ' A' ' 51' ' ' THR . 92.0 mt -103.98 -61.28 1.46 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.191 -0.459 . . . . 71.34 110.932 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.92 110.87 14.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 55.43 110.848 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.596 ' HB3' HD21 ' A' ' 34' ' ' LEU . 20.7 p-10 -118.24 41.36 2.96 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.824 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.5 t -100.13 -45.08 5.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.3 110.843 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.43 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.6 mmtm -76.35 154.64 34.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.145 -0.479 . . . . 73.24 110.94 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.43 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.36 -47.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 53.45 110.87 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.547 ' CH2' ' OE2' ' A' ' 23' ' ' GLU . 39.1 m95 -87.77 124.17 33.33 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.087 -0.506 . . . . 74.4 110.949 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.98 109.27 13.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.242 -0.436 . . . . 75.14 110.926 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.514 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 3.7 ttt180 -78.94 127.94 32.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.206 -0.452 . . . . 73.55 110.859 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.721 HG12 HD12 ' A' ' 34' ' ' LEU . 11.7 m -133.5 175.4 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.484 . . . . 53.22 111.157 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -122.56 148.59 45.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 63.03 110.857 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.503 ' HA ' HD12 ' A' ' 32' ' ' LEU . 2.0 t-20 -103.61 171.96 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.182 -0.463 . . . . 71.03 110.849 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 60.4 p -67.3 -19.27 65.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.871 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.443 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -81.95 10.01 7.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 52.44 110.893 179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.03 -2.13 2.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.426 . . . . 65.4 110.883 -179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.443 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.5 OUTLIER -78.53 166.13 22.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 63.24 110.917 179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.556 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -140.59 165.27 27.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 73.11 111.182 179.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 177.79 168.57 37.58 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.682 -0.77 . . . . 45.44 112.477 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.514 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -96.06 134.72 38.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.871 0.367 . . . . 70.52 110.878 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.87 151.24 55.94 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.537 0.684 . . . . 65.42 111.148 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.413 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.75 141.62 45.76 Favored 'Trans proline' 0 C--O 1.231 0.133 0 C-N-CA 122.665 2.243 . . . . 75.25 112.349 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.5 p -75.17 5.06 5.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.212 -0.449 . . . . 62.52 110.88 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -85.97 -18.37 32.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.23 110.88 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.547 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 8.0 m-85 -102.76 -23.25 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 72.24 110.973 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.418 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 14.5 m -119.29 177.62 2.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 55.13 111.07 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -163.03 128.0 3.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.12 -0.491 . . . . 75.04 110.918 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.677 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.0 ptp180 -67.99 140.41 56.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.225 -0.443 . . . . 75.11 110.845 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 168.42 1.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.156 -0.474 . . . . 61.44 110.896 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.425 ' CG ' ' O ' ' A' ' 63' ' ' ASN . 22.6 t30 -89.61 45.79 1.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.22 -0.445 . . . . 73.34 110.902 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 88.8 p -88.31 48.08 1.59 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 62.22 110.851 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -112.25 42.79 1.72 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 65.41 111.095 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -88.9 133.54 34.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.43 . . . . 74.53 110.869 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.57 -40.8 12.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.217 -0.447 . . . . 65.32 111.068 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.43 -55.03 17.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 72.33 111.115 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -82.66 96.41 8.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.256 -0.429 . . . . 71.54 111.179 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 67.24 166.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.243 -0.435 . . . . 75.11 110.849 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.0 m 51.91 91.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.475 . . . . 54.11 110.872 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 91.6 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 71.43 110.838 -179.806 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.472 -0.251 . . . . 51.3 112.472 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.62 130.05 53.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.94 0.4 . . . . 63.13 110.85 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.5 m -73.92 108.17 6.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 75.3 111.152 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.2 mtm -168.76 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 62.31 110.936 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.8 95.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 54.43 111.095 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 65.28 136.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.444 . . . . 73.34 110.85 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -93.51 137.93 32.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.063 -0.517 . . . . 73.15 110.856 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.3 t -120.85 145.88 26.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 74.13 111.106 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 145.48 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.142 -0.481 . . . . 74.24 111.134 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.475 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -133.35 153.98 38.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 64.32 111.13 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.533 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.1 p -118.87 113.51 41.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 71.33 111.146 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.67 129.57 40.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 65.24 111.104 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.1 ptmt -93.26 -24.14 18.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 70.41 110.893 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -128.27 -175.42 3.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 73.2 110.903 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -107.28 142.19 37.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.134 -0.485 . . . . 54.42 110.876 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.529 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.6 t80 -143.91 148.79 35.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.252 -0.431 . . . . 62.52 110.986 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 82.0 t -112.79 108.12 24.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 63.15 111.092 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.576 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -38.89 92.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 64.53 111.082 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -40.3 -66.41 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.24 110.932 -179.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -86.36 154.59 21.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.248 -0.433 . . . . 75.15 110.874 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -61.31 -18.92 60.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 72.51 110.889 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -78.78 -35.8 43.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.91 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 66.0 mt-10 -66.21 170.46 5.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.19 -0.459 . . . . 74.33 110.919 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -112.61 153.33 27.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 72.55 110.922 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -91.91 138.38 31.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 74.04 110.888 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.69 178.61 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.189 -0.46 . . . . 75.45 111.101 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.418 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.1 tppt? -152.13 141.73 21.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 63.25 110.836 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.1 tttt -53.25 124.01 13.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.893 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 74.28 37.52 0.59 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 65.23 110.87 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.23 126.95 55.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.108 -0.496 . . . . 62.54 110.874 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.469 ' C ' HD22 ' A' ' 32' ' ' LEU . 4.8 mmm-85 -92.39 114.44 26.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 64.34 110.908 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.603 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.8 mm? -108.64 164.02 12.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.166 -0.47 . . . . 65.11 110.919 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.4 m-90 -102.85 112.41 25.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.189 -0.46 . . . . 65.04 110.919 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.56 ' HG ' HG12 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -73.42 131.18 41.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.197 -0.456 . . . . 54.43 110.997 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.633 HD12 HG21 ' A' ' 51' ' ' THR . 83.5 mt -110.12 -41.93 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 52.01 110.871 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.65 111.2 5.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 63.22 110.896 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 34' ' ' LEU . 6.4 p30 -118.17 40.15 3.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 74.4 110.824 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 p -103.4 -45.07 4.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 61.14 110.843 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' A' ' 40' ' ' SER . 2.0 mmmt -74.79 155.49 37.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.066 -0.516 . . . . 72.14 110.953 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 39' ' ' LYS . 12.5 t -34.51 -54.12 0.53 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 73.3 110.866 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.403 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 42.5 m95 -85.18 126.57 33.75 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 63.32 110.937 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.548 ' CE3' HD11 ' A' ' 34' ' ' LEU . 7.5 m0 -79.48 107.77 12.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.947 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.569 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.2 ttt180 -79.08 125.35 29.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.14 110.823 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.56 HG12 ' HG ' ' A' ' 34' ' ' LEU . 18.0 m -134.54 175.57 10.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.189 -0.459 . . . . 51.35 111.165 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -118.58 160.01 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 63.41 110.85 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.428 ' HA ' HD12 ' A' ' 32' ' ' LEU . 7.0 t-20 -115.98 168.42 10.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 73.01 110.942 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 63.7 p -63.27 -24.13 67.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.189 -0.46 . . . . 74.4 110.821 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -79.76 10.75 3.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.115 -0.493 . . . . 74.24 110.863 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.552 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.78 -2.64 2.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 75.22 110.886 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 mtpt -78.45 152.69 31.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 74.15 110.94 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.633 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -132.24 155.64 47.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 75.12 111.149 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.424 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -170.93 -178.28 41.39 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.728 -0.749 . . . . 73.3 112.443 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.569 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.8 m-85 -106.42 126.58 52.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.381 . . . . 73.32 110.905 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.0 m -133.96 148.9 70.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.601 0.715 . . . . 71.15 111.141 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.403 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.1 Cg_endo -69.67 154.64 67.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.697 2.265 . . . . 75.21 112.365 179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 94.1 p -86.45 35.71 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 65.42 110.82 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -105.2 -38.14 6.65 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 55.11 110.815 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -105.73 29.45 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.245 -0.434 . . . . 72.43 110.969 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.458 ' HB ' HG21 ' A' ' 10' ' ' VAL . 18.2 m -153.81 161.04 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.488 . . . . 63.15 111.141 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -163.95 139.43 6.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.908 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.46 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 84.0 mtt180 -50.62 144.01 8.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.184 -0.462 . . . . 62.42 110.903 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 tttm -52.0 -68.21 0.19 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 72.14 110.863 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.46 ' ND2' ' O ' ' A' ' 61' ' ' ARG . 12.9 p30 38.6 69.5 0.26 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 61.31 110.933 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.5 t -79.29 -61.17 2.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.24 -0.436 . . . . 50.22 110.852 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -96.7 97.77 9.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.181 -0.463 . . . . 63.42 111.076 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.9 mtt180 53.04 100.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.207 -0.451 . . . . 71.12 110.839 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.53 -33.74 33.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.254 -0.43 . . . . 74.21 111.104 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.77 36.13 0.85 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.223 -0.444 . . . . 44.54 111.082 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.64 92.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.232 -0.44 . . . . 53.35 111.081 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.448 ' O ' ' C ' ' A' ' 71' ' ' SER . 25.0 m-80 -152.81 -47.3 0.1 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.22 -0.445 . . . . 74.42 110.883 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER 34.72 88.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 63.54 110.835 -179.835 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.092 -0.504 . . . . 52.43 110.874 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.471 -0.252 . . . . 73.34 112.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 t -120.15 86.48 2.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.919 0.39 . . . . 63.05 110.817 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.2 m -82.53 145.86 29.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 65.5 111.179 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtm -144.72 -61.68 0.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 74.1 110.83 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.01 99.74 6.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.25 -0.432 . . . . 74.2 111.119 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -151.89 91.11 1.59 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.214 -0.448 . . . . 74.53 110.911 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -114.69 137.45 51.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.836 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.454 ' CG1' ' HG2' ' A' ' 61' ' ' ARG . 70.1 t -124.72 141.84 43.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 74.24 111.154 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.77 138.39 54.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 54.34 111.178 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 61' ' ' ARG . 9.5 m -124.41 148.87 28.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 64.3 111.159 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -112.23 136.16 49.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 74.1 111.125 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.67 130.57 34.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 75.35 111.075 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.515 ' O ' ' CD1' ' A' ' 14' ' ' PHE . 14.0 ptmt -97.15 -10.53 25.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 75.52 110.847 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CD1' ' O ' ' A' ' 13' ' ' LYS . 27.8 m-85 -144.85 -176.42 5.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.909 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -106.73 140.51 39.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 75.55 110.911 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.1 t80 -142.95 148.87 37.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.989 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.0 t -112.23 107.89 24.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.131 -0.486 . . . . 63.22 111.155 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.56 90.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 73.04 111.135 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.493 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -43.39 -66.09 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.261 -0.427 . . . . 70.1 110.955 -179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.43 147.98 37.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.445 . . . . 73.01 110.879 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -61.7 -14.29 30.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.252 -0.431 . . . . 51.12 110.944 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -85.28 -28.88 25.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.55 110.91 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.536 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 45.8 mt-10 -72.74 159.74 33.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 64.02 110.89 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.49 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -105.5 144.32 32.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.96 179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.93 141.68 34.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 75.32 110.877 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.457 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 pt -119.32 176.49 3.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.164 -0.471 . . . . 71.54 111.157 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.11 141.75 21.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 72.45 110.923 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.1 tttt -50.87 132.99 27.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.831 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 62.62 42.41 8.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.218 -0.446 . . . . 63.32 110.941 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.46 119.01 32.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 65.11 110.901 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 6.2 mmm-85 -85.12 121.75 28.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 75.45 110.824 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.3 mm? -116.12 166.12 12.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.17 -0.468 . . . . 73.42 110.918 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.3 m-90 -99.72 118.52 36.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.222 -0.445 . . . . 75.54 110.923 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB3' ' A' ' 37' ' ' ASP . 20.9 tp -78.69 126.73 31.13 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 74.12 110.928 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.566 HD12 HG21 ' A' ' 51' ' ' THR . 78.8 mt -107.52 -61.81 1.51 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 64.43 110.993 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.62 111.0 14.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.491 . . . . 72.51 110.925 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.7 ' HB3' HD11 ' A' ' 34' ' ' LEU . 23.2 p-10 -117.98 30.35 7.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.236 -0.438 . . . . 75.21 110.921 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.9 t -91.55 -44.93 8.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 64.1 110.925 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.447 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -74.78 153.29 38.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.132 -0.486 . . . . 65.11 110.928 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.5 m -34.44 -49.36 0.39 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.279 -0.418 . . . . 74.42 110.865 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.408 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.5 m95 -86.03 124.58 32.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.41 110.878 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -78.82 108.12 12.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 73.41 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.532 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 1.7 ttt180 -78.96 126.96 31.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.889 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.444 HG12 HD12 ' A' ' 34' ' ' LEU . 5.3 m -132.75 175.18 11.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 74.13 111.125 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.487 ' O ' HD12 ' A' ' 32' ' ' LEU . 10.6 ttp180 -123.15 154.31 38.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 71.25 110.831 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.645 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.1 t-20 -110.43 169.69 8.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 73.22 110.869 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.3 t -64.89 -22.25 66.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.938 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.436 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 5.5 mmt -80.23 10.52 4.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 75.31 110.802 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.42 -4.38 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 75.1 110.909 -179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 9.3 mttt -75.87 158.35 32.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.888 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.566 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -139.46 153.63 47.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.22 -0.446 . . . . 71.21 111.206 179.925 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -170.35 168.4 41.42 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.778 -0.725 . . . . 64.43 112.49 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.5 m-85 -92.39 132.91 36.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.875 0.369 . . . . 74.11 110.867 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.2 m -142.36 151.22 57.47 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.601 0.715 . . . . 74.43 111.148 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.1 Cg_endo -69.78 159.79 52.09 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.735 2.29 . . . . 73.4 112.297 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.7 p -92.05 28.34 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 74.31 110.815 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -101.24 -23.15 14.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 64.31 110.884 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -104.25 -38.31 6.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.191 -0.459 . . . . 71.45 110.883 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.438 ' HB ' HG23 ' A' ' 10' ' ' VAL . 2.8 m -108.28 159.33 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.51 111.158 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.435 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 1.0 OUTLIER -164.06 143.59 7.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.879 -179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.586 ' HA ' HG12 ' A' ' 10' ' ' VAL . 27.2 mtm105 -50.28 142.39 10.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 73.15 110.888 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.54 166.31 0.31 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 72.44 110.861 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -46.74 -23.76 0.47 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 72.1 110.921 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 16.5 p -87.95 123.23 32.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 74.35 110.833 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -110.79 113.27 25.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 52.44 111.16 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 73.7 mtt180 59.82 121.63 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.189 -0.46 . . . . 73.4 110.905 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.14 -15.22 59.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 24.33 111.119 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -108.45 35.73 3.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.225 -0.443 . . . . 62.41 111.04 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -36.72 10.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 71.11 111.083 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.1 -53.7 53.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.235 -0.439 . . . . 61.42 110.973 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.55 127.53 7.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.109 -0.496 . . . . 74.13 110.833 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 64.41 110.837 -179.762 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.496 -0.242 . . . . 74.41 112.496 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 m -98.93 102.19 13.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.932 0.396 . . . . 61.5 110.891 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 25.9 m -54.82 127.32 27.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 45.0 111.184 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.7 mtt -67.36 147.07 53.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 70.33 110.885 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.99 178.96 3.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 71.41 111.078 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -84.11 100.24 11.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 62.02 110.883 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -65.53 176.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 71.25 110.881 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.78 143.1 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 45.21 111.154 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.85 137.29 57.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.163 -0.471 . . . . 74.55 111.132 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' ' 34' ' ' LEU . 1.9 m -122.1 142.22 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.133 -0.485 . . . . 54.31 111.127 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.416 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 8.1 p -106.24 146.44 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 72.04 111.147 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.89 126.87 38.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 53.43 111.126 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.573 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 15.0 ptmt -89.87 -16.44 30.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 72.05 110.885 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.573 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.1 m-85 -142.4 -177.83 5.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 74.45 110.88 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -103.02 142.08 34.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.962 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.7 t80 -142.15 149.15 39.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.435 . . . . 61.44 110.86 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.445 ' O ' ' N ' ' A' ' 19' ' ' GLN . 78.7 t -112.53 109.34 28.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.062 -0.517 . . . . 73.44 111.184 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.524 ' HA ' ' CE2' ' A' ' 16' ' ' TYR . . . -41.95 93.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.467 . . . . 63.32 111.119 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -43.88 -65.16 0.54 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 74.55 110.923 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -86.91 158.85 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.938 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -14.75 61.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.447 . . . . 73.24 110.931 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -82.74 -36.76 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 73.15 110.866 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.405 ' OE2' ' N ' ' A' ' 19' ' ' GLN . 41.2 mt-10 -66.85 159.3 28.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.221 -0.445 . . . . 72.55 110.834 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' A' ' 51' ' ' THR . 0.4 OUTLIER -106.95 136.66 46.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 72.43 110.91 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -73.97 146.01 44.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 70.32 110.907 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -124.85 179.16 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 64.12 111.104 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.3 tppt? -151.61 142.02 22.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.129 -0.487 . . . . 72.13 110.877 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.36 133.39 24.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.245 -0.434 . . . . 54.41 110.902 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.52 41.76 12.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.1 110.881 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -118.55 124.47 47.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 70.24 110.875 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.788 ' C ' HD22 ' A' ' 32' ' ' LEU . 12.1 mmm-85 -87.67 132.12 34.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 53.43 110.874 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.788 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -126.87 162.38 26.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.936 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.9 m-90 -97.02 118.27 33.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 63.21 110.973 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.581 HD12 HG12 ' A' ' 44' ' ' VAL . 17.0 tp -78.6 130.74 36.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.889 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 51' ' ' THR . 76.0 mt -110.91 -65.58 1.15 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.988 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -118.65 111.01 17.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.469 . . . . 71.23 110.845 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.572 ' HB3' HD21 ' A' ' 34' ' ' LEU . 8.5 p-10 -118.21 41.8 2.85 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.16 -0.473 . . . . 64.22 110.843 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.27 -45.0 4.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 62.23 110.849 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 40' ' ' SER . 4.7 mmtt -76.33 153.07 36.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.13 -0.486 . . . . 70.34 110.89 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.429 ' C ' ' O ' ' A' ' 39' ' ' LYS . 8.1 t -34.49 -51.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.52 110.853 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.421 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 38.7 m95 -83.18 122.31 28.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.084 -0.507 . . . . 65.15 110.92 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 6.7 m0 -77.41 110.81 12.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.192 -0.458 . . . . 55.13 110.916 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 45.9 ttt180 -78.96 129.26 34.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.273 -0.421 . . . . 75.22 110.853 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.581 HG12 HD12 ' A' ' 34' ' ' LEU . 10.6 m -135.51 172.34 15.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 34.32 111.083 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.745 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.2 ttp180 -121.04 156.67 31.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.851 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 32' ' ' LEU . 7.7 t-20 -112.88 168.28 9.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 54.34 110.863 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.9 p -63.54 -22.36 66.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 63.42 110.831 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.404 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 6.1 mmt -80.34 10.72 4.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 73.4 110.852 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.561 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.51 -4.64 2.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.238 -0.437 . . . . 75.35 110.907 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.404 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 0.9 OUTLIER -74.77 157.72 34.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.897 179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.544 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -139.92 147.45 40.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 71.34 111.127 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -163.65 174.4 39.85 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.753 -0.737 . . . . 71.11 112.507 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.6 m-85 -98.88 132.85 43.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.878 0.371 . . . . 55.0 110.872 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 15.7 m -142.35 151.15 57.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.641 0.734 . . . . 74.03 111.084 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.73 162.37 42.31 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.658 2.239 . . . . 63.11 112.379 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.3 p -96.0 26.44 4.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.216 -0.447 . . . . 72.43 110.817 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -98.63 -25.82 14.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 64.32 110.866 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -104.12 -26.67 12.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 73.03 110.907 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 19.3 m -108.48 167.03 4.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.192 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -163.04 133.13 4.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 73.23 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.452 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.2 ptm180 -64.89 141.33 58.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 62.44 110.907 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.6 tptt -56.2 143.12 34.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.22 -0.445 . . . . 61.55 110.908 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -101.38 -18.43 16.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 64.44 110.848 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.1 t -84.12 83.78 7.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 65.04 110.902 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -111.01 97.26 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.179 -0.464 . . . . 74.44 111.091 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.418 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . 24.5 mtt180 -63.39 131.9 49.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 74.31 110.906 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.06 -50.76 64.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.155 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.84 -48.88 72.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 63.31 111.099 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 66' ' ' ARG . . . -68.27 107.34 2.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.172 -0.467 . . . . 70.12 111.084 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -105.43 115.17 29.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.253 -0.43 . . . . 70.25 110.91 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -50.54 96.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.211 -0.45 . . . . 71.14 110.825 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 73.4 110.91 -179.877 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.47 -0.252 . . . . 73.43 112.47 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -162.47 -49.32 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.908 0.385 . . . . 70.53 110.876 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 93.9 m -59.65 137.09 58.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.21 111.141 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 mtm -120.67 156.96 30.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.256 -0.429 . . . . 74.42 110.895 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -91.52 144.88 25.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 74.5 111.12 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -39.46 104.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 64.41 110.844 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -131.16 -178.89 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 62.54 110.896 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.4 HG11 HD23 ' A' ' 34' ' ' LEU . 94.8 t -133.87 147.2 30.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 72.32 111.076 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.65 139.86 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.15 -0.477 . . . . 73.32 111.163 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG13 ' HB2' ' A' ' 34' ' ' LEU . 2.1 m -130.85 139.18 51.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 75.33 111.095 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.483 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.2 p -107.67 143.53 18.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.32 111.162 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.33 141.39 28.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 65.34 111.102 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.0 ptmt -104.28 -12.68 16.5 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.2 -0.455 . . . . 71.42 110.927 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.479 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 27.5 m-85 -142.37 176.64 8.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.883 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.1 138.44 35.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.446 . . . . 73.12 110.855 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.3 t80 -140.65 149.0 41.72 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.972 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.498 ' O ' ' N ' ' A' ' 19' ' ' GLN . 89.5 t -112.68 107.86 24.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 71.22 111.074 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.81 88.26 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 61.33 111.116 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.498 ' N ' ' O ' ' A' ' 17' ' ' VAL . 1.2 tp60 -46.84 -62.65 1.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.265 -0.425 . . . . 75.2 110.912 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -74.07 146.42 43.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.216 -0.447 . . . . 71.52 110.882 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -62.55 -16.16 54.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.863 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -84.34 -27.72 27.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 75.33 110.967 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 50.2 mt-10 -73.13 164.17 27.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 53.43 110.887 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.523 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.3 OUTLIER -111.4 147.26 35.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.956 -179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.401 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.5 OUTLIER -81.66 137.67 35.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.187 -0.46 . . . . 75.21 110.891 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.479 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.0 OUTLIER -117.96 179.18 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.132 180.0 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -150.33 144.67 25.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 64.21 110.87 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 2.5 tttm -53.8 117.62 3.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 70.2 110.959 179.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.19 38.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 71.52 110.824 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.435 ' CD ' HD21 ' A' ' 32' ' ' LEU . 2.3 tt0 -111.02 132.9 53.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 43.14 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' C ' HD22 ' A' ' 32' ' ' LEU . 0.6 OUTLIER -92.75 121.84 34.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 75.31 110.93 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.642 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.2 mm? -116.5 152.86 33.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 45.32 110.918 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 30.0 m-90 -92.12 112.59 24.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.215 -0.448 . . . . 75.02 110.916 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.637 HD21 ' OD2' ' A' ' 37' ' ' ASP . 21.7 tp -72.79 123.91 24.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.211 -0.45 . . . . 73.52 110.889 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.59 HD12 HG21 ' A' ' 51' ' ' THR . 86.3 mt -106.19 -49.59 3.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.47 . . . . 73.42 110.965 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.95 111.06 7.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 75.21 110.788 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.637 ' OD2' HD21 ' A' ' 34' ' ' LEU . 54.1 p30 -118.29 33.98 5.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 73.43 110.898 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.56 -44.83 8.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.157 -0.474 . . . . 74.13 110.856 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 10.4 mmtt -75.68 153.5 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.097 -0.501 . . . . 73.32 110.89 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 70.7 m -34.71 -44.15 0.2 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 65.21 110.897 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.502 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 52.5 m95 -90.49 126.95 36.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.138 -0.483 . . . . 74.25 110.975 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.471 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.6 m0 -81.6 107.99 14.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.884 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.491 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.3 125.98 30.19 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 72.42 110.85 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.628 HG12 HD12 ' A' ' 34' ' ' LEU . 14.2 m -133.73 173.95 13.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 64.21 111.043 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.426 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.7 ttp180 -120.12 155.39 33.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.912 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -112.1 165.57 12.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 62.14 110.876 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.5 p -61.44 -20.79 63.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 53.13 110.877 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.458 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 0.3 OUTLIER -81.61 10.27 6.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.476 . . . . 62.2 110.911 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.555 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.32 -4.16 2.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 50.21 110.929 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 2.0 mttp -77.33 158.28 30.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 64.31 110.876 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.59 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.71 149.5 45.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 73.24 111.097 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.71 159.06 32.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.739 -0.743 . . . . 73.14 112.516 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -83.04 139.53 33.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 74.3 110.855 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.408 HG22 ' O ' ' A' ' 42' ' ' TRP . 5.8 m -148.88 150.73 33.42 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.602 0.715 . . . . 74.14 111.126 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.502 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.73 169.0 19.9 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.714 2.276 . . . . 63.12 112.325 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 90.7 p -101.14 29.16 4.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 65.34 110.821 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -98.63 -28.91 13.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 33.31 110.889 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -103.58 -31.34 9.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.968 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.405 ' HB ' HG23 ' A' ' 10' ' ' VAL . 5.1 m -110.12 162.21 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.146 -0.479 . . . . 63.43 111.167 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.43 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 8.0 tt0 -164.08 137.15 5.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.177 -0.465 . . . . 74.55 110.859 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.523 ' HA ' HG12 ' A' ' 10' ' ' VAL . 10.9 ptm180 -61.38 143.4 55.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.864 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.35 164.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 75.33 110.923 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -130.28 -30.91 1.9 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 54.54 110.851 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.2 t -85.24 92.41 8.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 70.23 110.81 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.29 100.93 12.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 74.32 111.101 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.598 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 8.5 mtt180 -79.25 165.63 23.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.258 -0.428 . . . . 72.12 110.882 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.74 -48.76 11.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 63.41 111.082 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -90.04 36.72 0.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.24 -0.437 . . . . 74.45 111.027 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.598 ' HB2' ' HB2' ' A' ' 66' ' ' ARG . . . -98.27 33.98 2.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 72.22 111.114 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -98.62 163.57 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 64.53 110.937 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.4 81.8 2.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 50.5 110.857 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 63.4 p . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.119 -0.491 . . . . 74.23 110.849 -179.798 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.463 -0.255 . . . . 63.12 112.463 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -155.63 -48.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.922 0.392 . . . . 74.31 110.876 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.3 m -59.54 117.77 5.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.105 -0.498 . . . . 71.12 111.102 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.2 mtm 62.71 131.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 73.42 110.92 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.3 170.26 14.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.24 -0.436 . . . . 75.3 111.121 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -139.83 132.0 28.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.271 -0.422 . . . . 74.41 110.896 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -133.95 159.91 39.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.142 -0.481 . . . . 74.0 110.833 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.9 t -131.3 140.63 47.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.116 -0.493 . . . . 74.44 111.096 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.446 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.33 139.86 50.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 41.43 111.115 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.585 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.4 m -134.75 141.73 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 65.3 111.07 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.489 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 2.4 p -110.92 130.46 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.173 -0.467 . . . . 74.32 111.159 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.412 ' HB1' HD12 ' A' ' 26' ' ' ILE . . . -71.93 120.97 18.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 73.31 111.042 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 20.2 ptmt -84.17 -13.3 53.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 74.4 110.922 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.4 m-85 -138.45 -176.0 4.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 72.44 110.842 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -107.88 140.81 40.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.501 . . . . 55.22 110.901 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.526 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 8.6 t80 -149.36 147.51 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.961 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.481 ' O ' ' N ' ' A' ' 19' ' ' GLN . 93.3 t -109.06 112.92 42.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 54.34 111.08 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.646 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -44.09 90.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 62.35 111.106 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.481 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -42.24 -67.04 0.29 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 72.32 110.91 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -85.02 150.35 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 74.44 110.945 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -56.72 -25.69 55.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 55.25 110.936 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -70.87 -36.53 72.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 74.54 110.907 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -67.65 173.78 4.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.236 -0.438 . . . . 60.21 110.944 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.646 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -121.67 150.02 42.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 75.31 110.924 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -83.14 139.57 33.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.196 -0.456 . . . . 74.01 110.87 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.47 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 1.7 pt -118.1 172.79 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 54.25 111.087 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 tppt? -152.22 140.39 20.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.114 -0.493 . . . . 71.33 110.951 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -53.61 121.5 7.92 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 74.22 110.883 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 76.65 41.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.269 -0.423 . . . . 64.23 110.911 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -120.27 114.6 22.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 52.5 110.869 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.489 ' HD2' ' CG2' ' A' ' 11' ' ' VAL . 0.0 OUTLIER -81.31 121.84 26.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 73.22 110.909 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.2 mm? -117.38 169.69 9.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.255 -0.43 . . . . 75.3 110.94 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.8 m-90 -104.45 117.06 33.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.919 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.585 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -78.84 128.97 34.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 61.11 110.954 179.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.49 HD12 ' CG2' ' A' ' 51' ' ' THR . 64.9 mt -107.49 -41.68 5.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 62.34 110.861 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -144.63 110.96 5.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 63.21 110.928 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.506 ' HB2' ' CE2' ' A' ' 42' ' ' TRP . 6.4 p-10 -118.09 37.07 4.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 60.21 110.84 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.03 -45.15 4.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 72.01 110.859 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 40' ' ' SER . 3.2 mmtm -73.71 157.29 36.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.024 -0.535 . . . . 74.4 110.921 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 39' ' ' LYS . 22.3 m -34.4 -60.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 42.41 110.823 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.493 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.7 m95 -83.91 123.62 30.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.154 -0.476 . . . . 72.22 110.931 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.506 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 9.7 m0 -76.17 109.38 9.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.194 -0.457 . . . . 72.14 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.537 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 72.6 ttt180 -78.97 127.81 32.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 73.5 110.914 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.9 m -135.35 177.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 64.51 111.104 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.603 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -123.68 162.07 23.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 70.04 110.86 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.634 ' HA ' HD12 ' A' ' 32' ' ' LEU . 4.3 t-20 -117.17 169.85 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.929 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -64.58 -25.3 67.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.265 -0.425 . . . . 72.42 110.812 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.8 mmt -79.11 11.08 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.17 -0.468 . . . . 55.21 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.06 -3.75 2.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 51.53 110.89 -179.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.8 mtpt -76.05 150.84 37.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 74.21 110.925 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.49 ' CG2' HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -131.77 153.51 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.445 . . . . 73.12 111.158 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.529 ' N ' HD12 ' A' ' 24' ' ' LEU . . . -171.95 168.65 41.76 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 73.34 112.549 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.537 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.4 m-85 -92.09 137.41 32.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.842 0.353 . . . . 73.13 110.904 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.8 m -145.47 151.16 46.44 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.645 0.736 . . . . 73.12 111.112 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.531 ' HG2' ' CD1' ' A' ' 58' ' ' TYR . 54.2 Cg_endo -69.72 135.27 30.12 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.66 2.24 . . . . 72.33 112.347 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.0 p -68.78 -16.46 63.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 63.23 110.865 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -71.48 -7.88 50.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 74.3 110.92 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.531 ' CD1' ' HG2' ' A' ' 55' ' ' PRO . 20.8 m-85 -106.27 -33.1 7.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 60.2 110.897 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.407 ' HB ' HG23 ' A' ' 10' ' ' VAL . 11.3 m -107.84 178.66 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 53.02 111.118 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -164.09 133.14 3.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.173 -0.467 . . . . 70.22 110.9 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 ptm180 -64.22 136.44 57.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 52.35 110.872 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tptt -55.06 130.29 41.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 41.44 110.856 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -94.97 37.26 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 62.53 110.936 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.6 t -70.46 174.39 5.82 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 75.41 110.929 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.13 89.53 1.5 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 74.23 111.093 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 61.08 130.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 54.4 110.919 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.46 -26.14 35.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.122 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.49 32.3 1.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.19 -0.459 . . . . 51.14 111.095 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -105.04 78.49 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.25 -0.432 . . . . 64.33 111.087 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -144.11 -37.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 72.13 110.884 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m 55.51 167.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 72.34 110.878 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.31 110.885 -179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.471 -0.252 . . . . 73.32 112.471 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -129.08 78.26 1.84 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.902 0.382 . . . . 62.45 110.834 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.3 m -73.07 122.82 22.41 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 71.25 111.212 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.1 mtt -145.19 153.74 41.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.257 -0.429 . . . . 73.22 110.925 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -82.68 -47.63 11.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 62.15 111.164 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -102.5 94.28 5.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 72.44 110.908 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -123.91 95.0 4.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.461 . . . . 72.24 110.858 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.803 HG11 HD23 ' A' ' 34' ' ' LEU . 42.3 t -108.43 145.47 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.468 . . . . 74.13 111.108 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.58 139.89 50.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.145 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.803 HG12 ' HA ' ' A' ' 61' ' ' ARG . 13.8 m -136.25 152.38 29.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.175 -0.466 . . . . 73.01 111.116 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.32 147.29 17.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.115 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.21 120.95 32.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 63.22 111.091 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.544 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 17.2 ptmt -84.14 -17.29 40.56 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.248 -0.433 . . . . 71.32 110.964 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.544 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 27.2 m-85 -140.19 -176.48 4.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 52.11 110.868 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -103.73 139.65 38.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.467 . . . . 71.4 110.839 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.486 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 7.3 t80 -139.8 149.03 43.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 63.23 110.854 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.501 ' O ' ' N ' ' A' ' 19' ' ' GLN . 86.8 t -114.8 109.31 27.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 51.15 111.087 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.602 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -47.28 88.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 60.33 111.072 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.501 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -44.75 -62.23 1.29 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 64.22 110.894 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -82.71 147.84 28.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.285 -0.416 . . . . 53.2 110.927 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -59.07 -21.5 59.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 72.24 110.852 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.94 -34.25 59.86 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 71.32 110.943 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.429 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 70.0 mt-10 -67.82 171.73 6.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 65.53 110.904 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.602 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -114.91 153.36 30.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 75.23 110.969 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.29 134.54 34.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 43.32 110.878 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -120.15 175.92 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 51.15 111.19 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' N ' HG13 ' A' ' 26' ' ' ILE . 11.7 tppt? -152.16 140.88 20.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.289 -0.414 . . . . 74.24 110.9 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -48.51 122.96 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.261 -0.427 . . . . 73.23 110.935 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.5 39.76 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.817 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -117.85 118.12 31.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 70.31 110.932 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.811 ' C ' HD22 ' A' ' 32' ' ' LEU . 14.5 mmm-85 -82.66 130.91 35.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.174 -0.466 . . . . 73.33 110.9 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.1 mm? -127.02 165.29 19.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 71.11 110.938 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 21.5 m-90 -102.84 111.49 23.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 74.22 110.965 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.847 HD21 ' CG ' ' A' ' 37' ' ' ASP . 23.6 tp -75.55 130.86 39.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.238 -0.437 . . . . 75.41 110.912 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.479 HD12 HG21 ' A' ' 51' ' ' THR . 32.8 mt -109.9 -58.35 2.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.42 110.963 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -125.38 110.88 14.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 73.41 110.9 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.847 ' CG ' HD21 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -118.17 31.42 6.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.236 -0.438 . . . . 65.11 110.879 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.26 -45.05 7.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 71.13 110.915 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.452 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -74.18 155.45 38.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.053 -0.521 . . . . 74.31 110.88 179.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.439 ' C ' ' O ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -34.41 -60.5 0.42 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.175 -0.466 . . . . 64.31 110.851 -179.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.0 m95 -78.48 123.05 26.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.164 -0.471 . . . . 74.12 110.873 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.0 m0 -75.01 110.84 9.64 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.225 -0.443 . . . . 75.02 110.853 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.53 ' O ' HD12 ' A' ' 34' ' ' LEU . 46.4 ttt85 -79.04 129.97 35.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.219 -0.446 . . . . 72.03 110.892 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -136.43 175.65 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.169 -0.469 . . . . 61.41 111.146 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.721 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.9 ttp180 -124.53 159.7 30.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 55.42 110.873 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -117.63 167.39 11.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 73.3 110.954 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 41.9 t -61.93 -25.77 67.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 73.22 110.841 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.444 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.8 mmt -79.04 10.89 3.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.081 -0.509 . . . . 73.3 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.56 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.48 -4.53 2.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 70.0 110.937 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 24' ' ' LEU . 6.4 mtpt -73.95 141.99 45.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.075 -0.511 . . . . 73.34 110.864 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.479 HG21 HD12 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -128.64 132.24 48.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.174 -0.466 . . . . 61.22 111.105 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.561 ' H ' HD12 ' A' ' 24' ' ' LEU . . . -146.79 -179.8 23.17 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.74 -0.743 . . . . 52.23 112.501 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.516 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -103.02 135.39 44.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 72.24 110.825 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.9 m -144.3 150.99 50.21 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.598 0.713 . . . . 65.44 111.108 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.418 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.8 Cg_endo -69.74 152.24 69.38 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.667 2.245 . . . . 64.22 112.353 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.8 p -85.75 29.48 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.455 . . . . 44.43 110.886 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -102.75 -20.85 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.97 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 7.1 m-85 -105.55 -36.81 7.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 65.31 110.926 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -107.97 161.5 6.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.078 -0.51 . . . . 72.21 111.118 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.424 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 26.6 tt0 -164.01 146.85 9.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.127 -0.488 . . . . 73.01 110.913 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.803 ' HA ' HG12 ' A' ' 10' ' ' VAL . 74.3 mtt180 -49.88 133.81 21.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 74.02 110.82 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -46.84 -78.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 73.52 110.889 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -146.6 39.74 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 54.14 110.911 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 64.0 m -86.04 -37.84 18.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.174 -0.466 . . . . 71.03 110.875 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -88.24 101.73 14.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.02 111.071 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 58.53 100.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 74.14 110.901 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.3 -32.81 39.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.263 -0.426 . . . . 75.51 111.091 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -51.05 -63.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 62.22 111.118 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.78 96.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.212 -0.449 . . . . 71.32 111.109 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.05 173.77 9.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 72.53 110.826 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.92 170.25 2.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.169 -0.468 . . . . 72.44 110.924 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 72.35 110.839 -179.767 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.479 -0.248 . . . . 61.53 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.16 44.98 1.06 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.981 0.42 . . . . 72.42 110.826 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.0 m -64.98 130.17 42.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 63.14 111.189 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.34 156.37 15.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.236 -0.438 . . . . 71.32 110.835 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -83.36 -60.82 2.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 53.33 111.096 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 44.14 40.68 3.66 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.219 -0.446 . . . . 63.21 110.859 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -94.88 150.52 20.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 75.24 110.901 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.3 t -134.9 142.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 50.25 111.128 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.83 141.24 46.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.51 . . . . 75.51 111.127 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.729 HG12 ' HA ' ' A' ' 61' ' ' ARG . 3.0 m -133.28 143.97 37.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.455 . . . . 54.54 111.127 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.462 ' CG2' ' HD2' ' A' ' 31' ' ' ARG . 7.7 p -110.67 124.73 67.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 72.4 111.106 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.42 141.87 57.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 71.13 111.126 179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 11.0 mtpt -96.52 -38.55 9.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.271 -0.422 . . . . 53.44 110.922 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 37.6 m-85 -122.26 173.23 7.74 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 72.53 110.908 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.43 133.59 34.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.143 -0.48 . . . . 63.54 110.845 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.556 ' HB2' ' CD2' ' A' ' 58' ' ' TYR . 15.3 t80 -138.76 148.94 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.449 . . . . 75.13 110.901 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' N ' ' A' ' 19' ' ' GLN . 57.8 t -112.64 116.69 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 64.22 111.101 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.655 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.75 78.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.42 111.09 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.508 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -38.61 -62.09 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 73.42 110.956 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -74.9 148.63 39.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 64.35 110.9 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.82 -29.12 69.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.257 -0.429 . . . . 75.43 110.868 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -70.78 -36.98 73.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 53.23 110.911 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 49.8 mt-10 -65.09 166.03 10.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 72.43 110.879 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.655 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -114.27 147.7 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.122 -0.49 . . . . 74.24 110.88 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -83.43 136.17 34.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.475 . . . . 74.33 110.843 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 178.47 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.244 -0.435 . . . . 75.41 111.096 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.472 ' N ' HG13 ' A' ' 26' ' ' ILE . 4.1 tppp? -152.2 140.45 20.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.115 -0.493 . . . . 63.32 110.845 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -50.99 116.65 2.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 71.32 110.909 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 75.0 41.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.32 110.878 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 116.48 26.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.468 . . . . 73.42 110.891 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -68.63 145.87 53.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.3 110.874 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.458 HD13 HG21 ' A' ' 44' ' ' VAL . 18.4 mt -143.63 159.92 41.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.196 -0.456 . . . . 53.23 110.824 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 27.6 m-90 -100.86 117.93 35.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.42 110.907 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.478 HD21 ' HB3' ' A' ' 37' ' ' ASP . 33.8 tp -79.23 132.56 36.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.269 -0.423 . . . . 60.43 110.951 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.472 HD12 ' CG2' ' A' ' 51' ' ' THR . 38.3 mt -114.33 -61.53 1.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 65.22 110.987 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.62 111.26 16.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.173 -0.467 . . . . 61.52 110.882 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB3' HD21 ' A' ' 34' ' ' LEU . 5.4 p-10 -118.09 36.46 4.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 72.23 110.87 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.4 -44.87 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 52.32 110.863 -179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' O ' ' C ' ' A' ' 40' ' ' SER . 18.4 mmtt -73.49 152.38 40.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 71.02 110.943 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 39' ' ' LYS . 19.5 m -34.78 -45.63 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.28 -0.418 . . . . 64.13 110.851 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.409 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 30.9 m95 -90.33 127.37 36.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.181 -0.463 . . . . 74.32 110.928 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -80.44 112.29 17.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.27 -0.423 . . . . 73.42 110.946 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.484 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 49.2 ttt180 -79.46 129.54 34.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 73.42 110.89 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.458 HG21 HD13 ' A' ' 32' ' ' LEU . 18.2 m -132.5 172.51 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.13 111.094 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.411 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 4.3 ttp180 -123.22 152.62 41.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.861 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.5 t-20 -111.21 165.38 11.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 70.13 110.883 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.427 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 77.9 p -60.14 -23.97 64.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.105 -0.498 . . . . 74.31 110.852 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.67 8.71 4.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 74.52 110.825 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.577 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.16 -5.71 2.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 73.15 110.88 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -73.39 160.66 31.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.166 -0.47 . . . . 73.41 110.87 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.495 ' HA ' HD12 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -141.78 147.8 37.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.169 -0.469 . . . . 71.24 111.156 179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -167.26 156.84 28.93 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.74 -0.743 . . . . 71.01 112.507 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.3 m-85 -80.93 135.07 35.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.862 0.363 . . . . 72.52 110.889 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 13.8 m -143.39 150.77 52.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.678 0.751 . . . . 54.45 111.059 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.409 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.2 Cg_endo -69.81 127.04 13.98 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.68 2.253 . . . . 72.1 112.356 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.623 ' HA ' HG22 ' A' ' 59' ' ' VAL . 74.3 p -59.85 -13.0 8.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.13 -0.487 . . . . 75.41 110.883 -179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -68.02 -17.93 64.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.085 -0.507 . . . . 74.52 110.906 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.556 ' CD2' ' HB2' ' A' ' 16' ' ' TYR . 9.5 m-85 -102.23 -27.61 12.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 61.3 110.934 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.623 HG22 ' HA ' ' A' ' 56' ' ' SER . 5.2 m -110.24 174.27 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.086 -0.507 . . . . 74.35 111.161 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.32 136.89 5.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.248 -0.433 . . . . 64.2 110.85 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.729 ' HA ' HG12 ' A' ' 10' ' ' VAL . 14.3 ptm180 -56.29 144.07 31.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.136 -0.483 . . . . 74.31 110.937 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -48.98 -73.6 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 73.24 110.896 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 48.53 61.65 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 53.52 110.859 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 71.9 m -65.2 167.53 8.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.868 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.09 97.22 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.147 -0.479 . . . . 73.53 111.133 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -137.51 133.44 34.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.195 -0.457 . . . . 74.33 110.842 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.9 -24.7 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.441 . . . . 75.3 111.12 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -97.06 26.63 4.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 61.44 111.079 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.09 156.94 23.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.267 -0.424 . . . . 63.11 111.079 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -142.76 172.38 12.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.239 -0.437 . . . . 73.23 110.936 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.445 ' O ' ' C ' ' A' ' 72' ' ' SER . 0.1 OUTLIER 61.09 84.37 0.13 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 75.42 110.868 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.445 ' C ' ' O ' ' A' ' 71' ' ' SER . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 74.0 110.831 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.26 0 N-CA-C 112.484 -0.246 . . . . 72.21 112.484 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p 172.65 -31.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.904 0.383 . . . . 74.01 110.764 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 89.1 m -74.72 138.56 42.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 62.21 111.177 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mtt -149.36 171.08 17.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.235 -0.439 . . . . 75.53 110.862 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.65 177.82 4.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.181 -0.463 . . . . 44.42 111.088 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -45.47 104.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 73.45 110.903 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -126.58 151.4 47.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.201 -0.454 . . . . 70.04 110.83 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 98.1 t -118.97 147.29 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.068 -0.515 . . . . 73.12 111.082 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.57 142.87 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.49 . . . . 74.14 111.132 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.666 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.4 m -139.27 139.56 39.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.186 -0.461 . . . . 65.41 111.134 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.442 ' HB ' ' CD ' ' A' ' 31' ' ' ARG . 7.2 p -110.27 124.95 67.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.186 -0.461 . . . . 72.12 111.185 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.21 134.7 55.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 63.02 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.578 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 17.1 ptmt -96.91 -14.57 21.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 72.03 110.915 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.578 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.8 m-85 -134.13 -169.89 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 75.42 110.886 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.79 137.84 50.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 74.22 110.837 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.4 t80 -149.08 149.15 30.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 74.25 110.937 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' A' ' 19' ' ' GLN . 92.9 t -114.74 113.28 43.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.112 -0.495 . . . . 61.21 111.071 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.765 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -47.64 88.65 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.508 . . . . 71.42 111.111 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -36.18 -51.34 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 73.12 110.885 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -98.89 150.05 22.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.1 110.913 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.96 -18.37 56.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.909 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.23 -30.32 48.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 72.23 110.908 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.765 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 34.6 mt-10 -73.41 168.32 19.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 73.41 110.914 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.799 HD13 ' N ' ' A' ' 52' ' ' GLY . 5.5 tp -110.8 128.86 55.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.915 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.16 140.19 46.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 70.21 110.869 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.483 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.97 174.44 4.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 75.24 111.098 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -152.12 141.44 21.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.213 -0.449 . . . . 45.34 110.927 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 1.8 ttpt -48.43 112.86 0.65 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.294 -0.412 . . . . 65.23 110.928 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.45 42.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 74.22 110.86 179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -111.89 131.8 55.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 64.45 110.929 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.442 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 1.1 mmm180 -86.97 134.62 33.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 64.24 110.873 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.565 HD13 HG21 ' A' ' 44' ' ' VAL . 20.1 mt -137.06 149.95 47.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.22 -0.445 . . . . 73.04 110.895 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -94.93 112.59 24.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 74.4 110.898 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.96 128.38 35.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 52.42 110.87 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.972 HD12 HG21 ' A' ' 51' ' ' THR . 85.3 mt -111.4 -32.79 6.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 71.4 110.868 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -149.27 110.93 4.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.45 . . . . 74.53 110.837 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.456 ' HB3' HD11 ' A' ' 34' ' ' LEU . 8.5 p30 -118.04 35.96 4.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 61.05 110.929 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.88 -45.02 4.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 72.23 110.881 -179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -72.16 152.58 42.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 63.32 110.93 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.2 t -34.52 -53.66 0.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 71.14 110.817 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 30.1 m95 -88.4 121.68 31.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.171 -0.468 . . . . 70.23 110.903 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.5 m0 -74.13 108.14 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.211 -0.45 . . . . 74.55 110.905 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.546 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 2.9 ttm180 -79.0 118.47 21.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 73.14 110.846 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.565 HG21 HD13 ' A' ' 32' ' ' LEU . 9.8 m -125.12 168.72 17.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 72.13 111.163 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.47 ' O ' ' CD2' ' A' ' 32' ' ' LEU . 9.5 ttp180 -109.59 156.93 19.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 73.11 110.858 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.658 ' HB2' HD21 ' A' ' 24' ' ' LEU . 9.5 t-20 -118.05 160.55 21.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.93 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.401 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 98.6 p -56.6 -25.19 52.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 71.13 110.912 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.4 mmt -78.24 9.99 3.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.11 -0.496 . . . . 64.25 110.916 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.546 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 73.75 -3.51 2.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.172 -0.467 . . . . 73.33 110.896 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -83.46 141.85 31.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.161 -0.472 . . . . 73.11 110.886 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.972 HG21 HD12 ' A' ' 35' ' ' LEU . 1.6 m -124.93 119.01 27.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 72.1 111.189 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.799 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -129.42 159.04 22.34 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.737 -0.744 . . . . 62.13 112.471 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.546 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.1 m-85 -78.92 128.26 33.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 63.11 110.882 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 18.8 m -136.97 151.41 72.1 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 73.34 111.095 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 144.25 52.97 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.604 2.203 . . . . 64.2 112.328 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 84.8 p -79.99 12.26 2.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.818 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.39 -20.46 20.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 45.43 110.836 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.477 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 3.4 m-85 -102.63 -17.41 15.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 63.43 110.972 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.469 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 20.1 m -119.64 171.03 8.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 60.24 111.151 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.403 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.01 140.77 6.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 63.24 110.945 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.666 ' HA ' HG12 ' A' ' 10' ' ' VAL . 0.0 OUTLIER -55.79 143.53 30.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 73.43 110.932 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -45.02 -93.99 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 62.42 110.92 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.481 ' O ' ' N ' ' A' ' 65' ' ' ALA . 4.3 p-10 -116.39 8.13 14.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.451 . . . . 72.12 110.927 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.8 m -55.67 82.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.163 -0.471 . . . . 73.31 110.915 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' A' ' 63' ' ' ASN . . . -102.15 107.68 18.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.1 111.17 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -91.97 131.87 36.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 71.35 110.92 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.14 -44.08 89.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 72.54 111.159 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -49.08 -59.28 3.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 62.13 111.068 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.97 107.0 0.91 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.223 -0.444 . . . . 63.42 111.098 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -150.72 162.25 41.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 63.13 110.883 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 24.0 m -128.09 170.55 12.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 73.23 110.839 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 40.03 110.899 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.436 -0.266 . . . . 64.12 112.436 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.94 86.95 1.88 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.905 0.383 . . . . 62.32 110.88 -179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 27.8 m -74.59 139.7 43.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 62.02 111.103 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -44.49 148.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 73.14 110.857 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.07 98.44 5.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 64.45 111.098 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -158.92 39.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 62.34 110.868 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -142.09 176.27 9.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.162 -0.472 . . . . 71.24 110.86 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 87.4 t -121.13 146.71 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 75.25 111.226 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 136.64 59.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.416 . . . . 74.41 111.115 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 61' ' ' ARG . 14.7 m -121.57 148.91 24.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 74.15 111.1 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.2 p -111.76 141.5 27.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.12 111.137 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.54 130.08 35.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.46 . . . . 61.33 111.131 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.566 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 18.3 ptmt -97.83 -10.33 24.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.263 -0.426 . . . . 73.44 110.898 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 25.1 m-85 -142.95 177.21 8.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.24 -0.437 . . . . 64.3 110.858 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -102.39 139.36 38.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.104 -0.498 . . . . 75.13 110.873 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.2 t80 -142.83 149.11 38.17 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.47 . . . . 63.42 110.916 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLN . 85.9 t -114.15 110.18 31.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.484 . . . . 72.21 111.123 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.52 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -46.06 89.43 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 73.43 111.158 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.5 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -46.39 -63.72 0.93 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.212 -0.449 . . . . 71.41 110.93 -179.915 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -80.87 150.21 29.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 61.44 110.945 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -11.58 16.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.239 -0.437 . . . . 73.34 110.887 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -37.42 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.226 -0.443 . . . . 72.35 110.867 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -67.55 168.96 10.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.274 -0.421 . . . . 74.35 110.856 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.52 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.5 OUTLIER -116.33 143.93 44.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.196 -0.456 . . . . 74.31 110.929 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.35 140.63 38.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.866 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.464 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -122.71 178.96 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.187 -0.461 . . . . 61.32 111.132 -179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -152.13 141.22 21.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.194 -0.457 . . . . 54.41 110.949 179.841 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.34 127.75 18.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.227 -0.442 . . . . 73.13 110.93 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 67.03 43.2 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 64.33 110.886 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.8 126.73 51.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.479 . . . . 72.53 110.846 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.851 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -89.88 135.35 33.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 73.35 110.828 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.851 HD22 ' C ' ' A' ' 31' ' ' ARG . 3.3 mm? -130.41 163.75 26.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.35 110.869 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 28.8 m-90 -95.02 114.91 26.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.169 -0.469 . . . . 73.2 110.922 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 37' ' ' ASP . 44.7 tp -76.81 134.98 38.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.279 -0.419 . . . . 74.13 110.931 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' CD1' HG21 ' A' ' 51' ' ' THR . 21.2 mt -117.26 -61.21 1.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 43.43 110.891 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.08 110.91 16.36 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.826 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.474 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.0 p-10 -118.13 36.58 4.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 74.44 110.843 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.75 -44.4 5.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.208 -0.451 . . . . 44.23 110.92 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -75.15 154.99 37.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.077 -0.511 . . . . 65.41 110.906 179.874 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.427 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.4 t -34.9 -59.32 0.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 71.44 110.902 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 37.1 m95 -78.8 125.43 29.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.484 . . . . 73.03 110.866 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -77.71 112.2 14.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.211 -0.45 . . . . 72.14 110.929 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.44 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 44.8 ttt180 -79.54 127.98 32.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.271 -0.422 . . . . 71.1 110.865 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.441 ' O ' ' CG2' ' A' ' 51' ' ' THR . 25.6 m -130.93 177.29 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.455 . . . . 74.43 111.109 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.492 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.6 ttp180 -129.71 146.94 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.889 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.422 ' HA ' HD12 ' A' ' 32' ' ' LEU . 8.7 t-20 -103.36 171.45 7.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.171 -0.468 . . . . 62.45 110.86 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.0 p -67.03 -19.23 65.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 60.34 110.841 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 1.6 mmt -82.59 10.54 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.163 -0.471 . . . . 74.0 110.878 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.6 -4.77 2.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 71.42 110.868 -179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 154.83 38.31 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 64.44 110.94 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.449 HG21 ' CD1' ' A' ' 35' ' ' LEU . 0.2 OUTLIER -137.39 147.23 45.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 71.24 111.099 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -164.87 169.57 39.59 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.751 -0.738 . . . . 64.21 112.494 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.44 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 8.2 m-85 -93.62 137.63 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.88 0.371 . . . . 73.11 110.905 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.9 m -146.59 151.61 43.37 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.666 0.746 . . . . 72.13 111.105 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.77 137.68 36.0 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.752 2.301 . . . . 72.25 112.307 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 73.9 p -67.99 -7.67 30.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.243 -0.435 . . . . 74.33 110.954 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 m-20 -68.65 -20.59 64.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 53.31 110.871 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.456 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 19.0 m-85 -102.21 -45.9 4.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.445 . . . . 64.53 110.907 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.3 m -107.98 159.65 7.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 75.14 111.154 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.436 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 46.2 tt0 -164.09 145.45 8.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 73.24 110.864 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.654 ' HA ' HG12 ' A' ' 10' ' ' VAL . 8.7 mtm180 -49.92 143.28 7.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 71.05 110.86 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -42.22 159.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 43.35 110.929 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.14 -24.34 8.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.261 -0.427 . . . . 60.41 110.888 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 21.6 t -54.24 -42.49 69.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 54.33 110.846 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.83 97.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.096 -0.502 . . . . 62.42 111.14 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.9 mtt180 51.45 100.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.234 -0.439 . . . . 70.22 110.83 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.02 -40.19 69.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 64.54 111.134 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -50.79 -37.74 44.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 41.11 111.093 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.416 ' O ' ' N ' ' A' ' 71' ' ' SER . . . -43.77 124.86 3.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.245 -0.434 . . . . 75.34 111.134 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.42 ' CG ' ' O ' ' A' ' 70' ' ' ASN . 22.1 p-10 -45.06 94.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.265 -0.425 . . . . 73.24 110.879 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 69' ' ' ALA . 0.4 OUTLIER -103.63 6.15 36.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.162 -0.472 . . . . 73.42 110.779 -179.766 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.14 -0.482 . . . . 75.31 110.826 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.357 0 N-CA-C 112.492 -0.243 . . . . 73.21 112.492 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.37 88.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.934 0.397 . . . . 64.12 110.853 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.7 m -74.01 144.19 45.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 75.43 111.149 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.0 mtt -77.23 -49.39 15.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 71.2 110.845 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.43 155.58 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.216 -0.447 . . . . 74.14 111.062 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 61.32 91.23 0.06 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 75.03 110.885 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -163.0 137.24 6.21 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.14 -0.482 . . . . 72.2 110.887 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 40.3 t -138.38 144.78 29.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 64.42 111.098 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.47 142.37 43.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.461 . . . . 71.04 111.162 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 61' ' ' ARG . 2.8 m -129.75 135.88 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.485 . . . . 62.32 111.168 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 11' ' ' VAL . 11.7 p -101.57 124.19 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 75.24 111.164 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.12 136.42 52.2 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.044 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.577 ' HG3' ' CD2' ' A' ' 14' ' ' PHE . 15.6 ptmt -104.7 -8.13 19.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 72.41 110.865 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' A' ' 13' ' ' LYS . 25.3 m-85 -144.9 -176.22 4.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -108.94 130.47 55.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 73.34 110.859 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.484 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 12.3 t80 -134.93 149.0 50.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 73.1 110.972 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.505 ' O ' ' N ' ' A' ' 19' ' ' GLN . 70.8 t -114.55 116.91 53.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 72.44 111.146 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.622 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -57.38 79.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 62.53 111.129 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -41.01 -56.08 2.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 62.53 110.959 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -82.74 141.9 32.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.112 -0.495 . . . . 64.31 110.922 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -57.1 -22.19 37.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 63.32 110.925 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -76.22 -37.45 57.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 72.51 110.885 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 79.9 mt-10 -69.12 163.04 25.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.234 -0.439 . . . . 71.54 110.871 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.622 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.4 OUTLIER -107.7 147.16 31.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.494 . . . . 43.41 110.895 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.23 134.45 34.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.867 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.484 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.5 OUTLIER -118.01 178.9 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 75.12 111.193 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.479 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.07 142.82 22.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.907 179.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -54.86 123.23 12.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 74.43 110.862 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 75.35 39.46 0.36 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 70.43 110.955 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -121.48 123.46 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.115 -0.493 . . . . 74.43 110.909 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.701 ' C ' HD22 ' A' ' 32' ' ' LEU . 9.3 mmm-85 -84.28 127.58 34.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.152 -0.476 . . . . 73.3 110.892 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.701 HD22 ' C ' ' A' ' 31' ' ' ARG . 2.9 mm? -121.14 167.7 12.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 44.34 110.923 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 26.2 m-90 -103.79 112.95 26.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 73.53 110.876 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.729 HD12 HG12 ' A' ' 44' ' ' VAL . 23.9 tp -74.23 125.1 27.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 73.25 110.876 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.595 HD12 HG21 ' A' ' 51' ' ' THR . 95.8 mt -103.47 -62.64 1.27 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 75.24 110.954 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.15 111.28 15.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 71.02 110.82 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.594 ' HB3' HD21 ' A' ' 34' ' ' LEU . 13.2 p-10 -118.0 34.62 5.08 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.245 -0.434 . . . . 52.14 110.879 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -44.56 6.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.169 -0.469 . . . . 64.23 110.874 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 10.6 mptt -75.87 159.01 31.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.082 -0.508 . . . . 72.13 110.842 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.435 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.0 m -35.14 -60.9 0.45 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 71.14 110.844 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 34.6 m95 -79.32 131.08 36.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.32 110.963 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.2 m0 -82.56 111.44 18.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.256 -0.429 . . . . 72.43 110.923 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.563 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 35.5 ttt85 -80.3 123.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 55.25 110.887 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.729 HG12 HD12 ' A' ' 34' ' ' LEU . 14.1 m -131.3 171.61 17.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.35 111.105 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.695 ' O ' HD12 ' A' ' 32' ' ' LEU . 11.3 ttp180 -117.11 160.83 20.39 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.146 -0.479 . . . . 75.44 110.883 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -117.73 166.63 12.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 71.11 110.899 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.9 p -61.24 -23.44 65.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 42.4 110.841 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 2.2 mmt -78.56 9.54 3.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 73.24 110.86 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.25 -4.08 2.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 64.12 110.892 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.1 mtpt -76.96 166.22 23.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.174 -0.466 . . . . 62.21 110.905 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.595 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -143.44 159.32 42.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 60.4 111.203 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.44 164.93 34.97 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.722 -0.751 . . . . 40.43 112.454 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.563 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.1 m-85 -90.24 130.34 36.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.848 0.356 . . . . 73.54 110.887 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 17.7 m -139.25 151.38 67.25 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.652 0.739 . . . . 74.23 111.097 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 145.44 57.06 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.637 2.225 . . . . 74.34 112.349 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.8 p -78.57 8.89 4.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.257 -0.429 . . . . 74.24 110.841 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -91.2 -19.3 23.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.124 -0.489 . . . . 65.55 110.913 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.498 ' CD1' ' HB2' ' A' ' 14' ' ' PHE . 3.1 m-85 -97.99 -29.98 12.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 70.01 110.896 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.43 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 15.4 m -109.89 177.48 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 72.14 111.1 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -159.73 122.59 3.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.11 -0.495 . . . . 74.21 110.856 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 10' ' ' VAL . 4.8 ptm180 -65.76 143.9 57.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.946 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.432 ' O ' ' CZ ' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -46.21 170.08 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.264 -0.425 . . . . 70.13 110.872 179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -135.49 -33.92 0.86 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.51 110.905 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 19.9 m -76.22 83.67 3.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.12 110.854 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -109.09 81.39 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 73.4 111.028 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -144.81 157.74 44.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 75.2 110.861 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.32 -44.4 79.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 44.12 111.117 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -52.92 -45.08 67.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.485 . . . . 61.42 111.161 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -46.53 112.99 0.57 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 70.44 111.148 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.423 ' OD1' ' C ' ' A' ' 70' ' ' ASN . 28.5 t-20 -49.61 111.58 0.52 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 64.33 110.916 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 78.8 p -145.75 113.9 6.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 63.22 110.865 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.178 -0.465 . . . . 61.2 110.887 -179.788 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.42 -0.272 . . . . 74.33 112.42 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.4 m -112.48 84.85 2.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.914 0.388 . . . . 64.13 110.799 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.417 ' O ' ' C ' ' A' ' 4' ' ' MET . 54.3 m -61.74 141.05 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 71.24 111.128 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.417 ' C ' ' O ' ' A' ' 3' ' ' THR . 5.7 mtm -37.06 153.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 52.13 110.928 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.417 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -71.08 -65.75 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.23 -0.441 . . . . 75.22 111.082 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' A' ' 5' ' ' ALA . 22.2 tt0 36.39 50.94 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 73.41 110.866 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.08 -168.73 2.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 72.23 110.804 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.79 HG11 HD23 ' A' ' 34' ' ' LEU . 18.2 t -121.08 113.23 38.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.1 -0.5 . . . . 63.33 111.064 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -126.19 140.0 49.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.445 . . . . 51.33 111.174 179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.501 HG23 ' HB ' ' A' ' 59' ' ' VAL . 4.8 m -126.67 141.01 47.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 73.54 111.122 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.419 ' CG2' ' HD3' ' A' ' 31' ' ' ARG . 8.6 p -102.14 147.54 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 73.35 111.175 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.27 139.14 30.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 21.52 111.083 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -103.48 -29.55 11.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 72.23 110.912 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.24 165.56 23.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.242 -0.435 . . . . 71.15 110.926 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.85 137.63 33.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.489 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 6.5 t80 -139.52 149.03 43.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 70.11 110.89 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 58.4 t -113.05 109.59 29.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 72.32 111.138 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.536 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -50.78 86.29 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 73.23 111.124 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.1 mm-40 -44.87 -62.14 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 71.01 110.882 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.35 149.07 37.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 53.54 110.907 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.34 -24.32 67.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 62.24 110.94 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -77.06 -30.15 55.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.144 -0.48 . . . . 72.04 110.887 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.491 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 63.7 mt-10 -68.78 163.87 23.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 72.33 110.921 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.536 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.2 OUTLIER -111.23 144.35 40.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.233 -0.439 . . . . 74.45 110.946 -179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.419 ' H ' HD23 ' A' ' 24' ' ' LEU . 0.3 OUTLIER -82.86 138.28 33.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 75.13 110.879 179.838 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.7 OUTLIER -121.11 179.01 2.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 75.21 111.155 179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.465 ' N ' HG13 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -152.19 140.93 20.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.227 -0.442 . . . . 62.55 110.894 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 11.7 tttt -45.96 117.47 1.52 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 74.1 110.9 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.413 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.5 OUTLIER 76.86 34.87 0.41 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 63.23 110.837 179.94 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -106.92 119.33 39.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.231 -0.44 . . . . 61.24 110.93 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.419 ' HD3' ' CG2' ' A' ' 11' ' ' VAL . 0.2 OUTLIER -76.43 133.7 39.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 75.23 110.919 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 45' ' ' ARG . 10.3 mt -134.07 144.51 48.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 73.24 110.947 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 24.2 m-90 -90.87 130.73 36.79 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 74.12 110.948 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.79 HD23 HG11 ' A' ' 8' ' ' VAL . 31.8 tp -85.01 124.32 31.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.44 . . . . 73.22 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 32.5 mt -107.14 -54.15 2.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 63.45 110.898 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -132.19 110.87 10.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 41.42 110.872 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.613 ' CG ' HD21 ' A' ' 34' ' ' LEU . 1.2 p-10 -118.26 34.73 5.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.459 . . . . 71.41 110.791 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.9 t -94.04 -45.05 7.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 53.1 110.822 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 40' ' ' SER . 17.1 mmtt -75.28 153.56 37.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.211 -0.449 . . . . 71.35 110.917 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 39' ' ' LYS . 3.1 t -34.49 -48.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.243 -0.435 . . . . 65.54 110.9 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 36.6 m95 -86.65 127.78 34.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.084 -0.507 . . . . 75.21 110.907 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -80.7 111.82 17.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.259 -0.428 . . . . 73.45 110.983 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.449 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 55.6 ttt180 -79.08 126.74 31.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 61.5 110.859 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.2 m -130.52 171.97 16.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.235 -0.438 . . . . 65.45 111.135 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.599 ' O ' HD23 ' A' ' 32' ' ' LEU . 5.8 ttp180 -123.19 156.28 35.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 72.13 110.904 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.407 ' OD1' ' N ' ' A' ' 47' ' ' SER . 13.4 t-20 -117.99 160.28 21.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 63.22 110.939 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.407 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 99.7 p -55.25 -21.56 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 64.13 110.837 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.64 8.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 75.15 110.882 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.563 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.68 -4.98 2.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.894 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 mttt -75.15 145.42 42.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.888 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -133.2 145.04 50.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 73.2 111.161 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.67 178.17 36.78 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.759 -0.734 . . . . 61.11 112.524 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.449 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.8 m-85 -99.71 128.51 45.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.875 0.369 . . . . 72.23 110.834 -179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 16.6 m -140.83 150.8 60.95 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-O 121.626 0.727 . . . . 74.23 111.096 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.498 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.8 160.63 49.0 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.645 2.23 . . . . 54.02 112.353 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.5 p -93.03 31.29 1.45 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 54.34 110.902 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.7 -24.47 13.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 64.2 110.844 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.01 -25.3 13.05 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.888 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.501 ' HB ' HG23 ' A' ' 10' ' ' VAL . 12.8 m -114.68 161.4 13.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 71.1 111.076 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.426 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 0.9 OUTLIER -164.09 149.53 10.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 71.22 110.913 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -64.08 136.67 57.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 75.02 110.855 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' A' ' 63' ' ' ASN . 3.4 ttpm? -60.55 -73.97 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.208 -0.451 . . . . 71.43 110.897 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' C ' ' O ' ' A' ' 62' ' ' LYS . 0.5 OUTLIER 35.83 39.42 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 74.34 110.921 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.4 p -83.39 119.58 24.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 71.03 110.842 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -98.6 38.52 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 64.55 111.093 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.403 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -116.42 134.19 55.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.45 . . . . 54.22 110.911 -179.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -80.44 -33.19 37.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.234 -0.439 . . . . 53.25 111.039 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.81 -58.23 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.229 -0.441 . . . . 62.31 111.082 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.04 107.26 0.15 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 73.13 111.04 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.43 ' O ' ' C ' ' A' ' 71' ' ' SER . 38.4 p-10 -157.79 134.97 10.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 70.2 110.887 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.431 ' O ' ' C ' ' A' ' 72' ' ' SER . 68.5 p 35.24 90.45 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 63.32 110.823 -179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 71' ' ' SER . 35.0 t . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.87 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.443 -0.263 . . . . 70.34 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.28 -80.33 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.925 0.393 . . . . 61.22 110.82 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.07 106.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.16 -0.473 . . . . 60.33 111.172 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttp -170.64 -42.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.237 -0.438 . . . . 74.42 110.904 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.37 131.92 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.27 -0.423 . . . . 72.53 111.087 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.52 93.44 4.15 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 75.33 110.836 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.37 176.67 7.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 63.24 110.901 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 74.3 t -109.48 138.08 38.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 52.54 111.173 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.03 139.46 49.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.166 -0.47 . . . . 62.3 111.146 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.442 ' CG2' ' HB ' ' A' ' 59' ' ' VAL . 2.3 m -123.56 141.33 44.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 72.35 111.12 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.6 p -107.34 136.37 42.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 43.33 111.137 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 27' ' ' LYS . . . -84.03 141.72 30.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 32.12 111.083 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 6.1 mtpt -100.74 -30.43 11.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 74.2 110.847 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 70.0 m-85 -134.92 162.2 33.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 72.44 110.902 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -82.83 137.77 34.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 72.33 110.794 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.56 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.6 t80 -136.22 149.09 48.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 75.43 110.89 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' A' ' 19' ' ' GLN . 67.0 t -111.13 108.01 24.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.129 -0.487 . . . . 73.2 111.103 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.636 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -44.02 90.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 61.11 111.082 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.491 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.3 OUTLIER -37.37 -70.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.225 -0.443 . . . . 72.13 110.928 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -78.89 144.8 34.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.19 -0.459 . . . . 62.13 110.932 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -22.15 10.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.188 -0.46 . . . . 74.43 110.938 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -74.27 -36.73 63.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.964 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.636 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 60.4 mt-10 -65.73 159.09 25.85 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 62.12 110.879 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.3 tp -108.37 129.46 55.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.219 -0.446 . . . . 71.14 110.897 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' ' 24' ' ' LEU . 4.4 p30 -66.56 150.71 48.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 75.11 110.87 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -126.26 179.28 3.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 70.55 111.095 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.0 tppt? -147.92 144.24 27.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.3 110.841 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -63.0 136.31 57.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.203 -0.453 . . . . 70.22 110.919 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 63.11 31.6 15.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.33 110.813 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -113.79 115.78 28.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 74.13 110.896 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.481 ' N ' ' HD3' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -74.62 117.67 16.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 74.33 110.8 -179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.6 mt -110.37 164.66 12.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.154 -0.475 . . . . 73.33 110.889 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 13.8 m-90 -104.86 126.08 51.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.161 -0.472 . . . . 70.3 110.91 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.786 HD21 ' HB3' ' A' ' 37' ' ' ASP . 13.8 tp -83.75 135.16 34.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 75.31 110.911 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.886 HD12 HG21 ' A' ' 51' ' ' THR . 38.0 mt -122.86 -27.33 4.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.43 110.915 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.82 112.86 2.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 75.41 110.957 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.786 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -117.99 -10.19 10.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.252 -0.431 . . . . 75.41 110.876 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.09 -44.68 94.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 51.53 110.83 -179.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.2 OUTLIER -69.77 149.57 47.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 73.32 110.853 179.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.448 ' C ' ' O ' ' A' ' 39' ' ' LYS . 27.8 t -34.6 -56.12 0.54 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.45 . . . . 54.02 110.884 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 29.4 m95 -86.11 126.2 34.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 61.31 110.922 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.518 ' CE2' ' HB2' ' A' ' 37' ' ' ASP . 21.1 m0 -77.84 106.24 9.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 63.31 110.931 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.528 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 0.2 OUTLIER -78.89 116.27 19.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.283 -0.417 . . . . 72.3 110.827 -179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.633 ' O ' HG23 ' A' ' 51' ' ' THR . 28.4 m -119.79 171.7 7.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 71.34 111.133 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -116.58 155.28 28.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.914 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -118.02 159.16 23.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 72.52 110.915 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 54.0 p -54.6 -24.21 20.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.179 -0.464 . . . . 53.45 110.809 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.43 9.65 5.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 63.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.575 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 75.05 -5.69 2.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.826 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -74.86 141.92 44.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 71.33 110.919 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.886 HG21 HD12 ' A' ' 35' ' ' LEU . 1.5 m -135.06 120.14 18.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 71.41 111.103 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.47 ' N ' ' HB2' ' A' ' 24' ' ' LEU . . . -137.88 165.37 25.37 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.714 -0.755 . . . . 61.33 112.488 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.528 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 5.4 m-85 -81.03 125.75 30.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.931 0.396 . . . . 71.02 110.889 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.9 m -134.92 151.21 75.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.695 0.759 . . . . 74.21 111.111 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.507 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.4 Cg_endo -69.7 155.1 67.03 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.716 2.277 . . . . 64.45 112.354 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 51.9 p -88.2 32.67 0.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 63.31 110.867 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -105.31 -32.68 8.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.123 -0.49 . . . . 61.13 110.886 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -94.83 -28.93 14.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 72.13 110.963 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.442 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 16.3 m -111.81 162.73 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.094 -0.503 . . . . 72.44 111.108 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -164.11 143.09 7.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 65.51 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.74 143.5 30.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.11 110.909 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tptp -53.39 132.49 39.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 72.02 110.955 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -105.92 33.67 3.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 65.03 110.902 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 89.0 p -87.36 84.55 7.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 40.23 110.853 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.49 -156.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 64.51 111.084 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.5 ttt85 -50.75 141.74 12.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 73.24 110.858 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.53 -52.55 59.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.04 111.093 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.49 -53.66 55.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 64.41 111.148 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.12 143.15 57.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 55.33 111.052 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 m120 60.39 118.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.479 . . . . 71.03 110.908 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.29 164.16 0.93 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 63.03 110.858 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 54.25 110.878 -179.798 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 112.53 -0.228 . . . . 62.11 112.53 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.5 p -163.92 76.98 0.37 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.92 0.39 . . . . 72.34 110.855 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.48 179.18 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 64.55 111.144 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -68.7 153.59 43.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 75.43 110.92 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.71 92.09 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.273 -0.421 . . . . 44.41 111.157 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -137.84 82.34 1.91 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 61.21 110.92 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -142.88 157.0 45.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.069 -0.514 . . . . 74.24 110.891 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.429 ' O ' ' N ' ' A' ' 34' ' ' LEU . 87.1 t -127.06 141.98 44.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.17 -0.468 . . . . 54.23 111.057 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 32' ' ' LEU . 0.0 OUTLIER -127.83 137.55 57.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.114 -0.493 . . . . 70.43 111.101 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.855 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.6 m -124.82 147.43 29.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 65.43 111.154 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.544 ' O ' HG13 ' A' ' 11' ' ' VAL . 7.4 p -112.66 112.35 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 75.1 111.162 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 125.18 21.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.274 -0.421 . . . . 43.44 111.126 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.58 ' HE2' ' CZ ' ' A' ' 14' ' ' PHE . 19.7 ptmt -93.83 -6.7 45.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 71.12 110.876 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.58 ' CZ ' ' HE2' ' A' ' 13' ' ' LYS . 28.4 m-85 -142.92 -169.65 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.261 -0.427 . . . . 73.2 110.908 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -114.59 139.5 49.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.462 . . . . 54.31 110.894 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.576 ' HB2' ' CE2' ' A' ' 58' ' ' TYR . 15.0 t80 -149.04 149.12 30.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.01 0.434 . . . . 73.03 110.895 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.502 ' O ' ' N ' ' A' ' 19' ' ' GLN . 75.8 t -111.65 122.57 66.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.489 . . . . 63.02 111.159 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.769 ' HB2' ' C ' ' A' ' 24' ' ' LEU . . . -56.14 80.97 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.04 111.028 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.502 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.5 OUTLIER -35.94 -65.71 0.24 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 72.2 110.916 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -80.5 150.36 29.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 71.15 110.912 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -59.67 -26.4 65.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.205 -0.452 . . . . 72.03 110.886 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.76 70.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 72.11 110.869 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.416 ' C ' ' HB1' ' A' ' 18' ' ' ALA . 51.0 mt-10 -69.92 162.4 28.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 75.24 110.868 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.769 ' C ' ' HB2' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -107.93 152.44 24.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 63.22 110.949 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.42 138.02 31.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.225 -0.443 . . . . 75.13 110.921 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -117.89 178.02 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.267 -0.424 . . . . 74.22 111.141 179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.455 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.1 tppt? -152.18 141.05 21.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 71.22 110.907 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.438 ' O ' ' CB ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -49.39 115.14 1.21 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 74.32 110.88 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' CB ' ' O ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER 78.53 45.18 0.06 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.86 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -113.92 124.19 51.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 74.11 110.854 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' CD ' ' HB ' ' A' ' 11' ' ' VAL . 3.5 mmm180 -86.66 112.81 21.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 74.21 110.859 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.609 HD12 ' HA ' ' A' ' 46' ' ' ASN . 3.1 mm? -116.36 170.83 8.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.949 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.409 ' HA ' HG12 ' A' ' 9' ' ' VAL . 24.2 m-90 -107.32 117.1 33.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.16 -0.473 . . . . 75.43 110.856 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.6 OUTLIER -76.59 131.8 39.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 72.41 110.944 179.921 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.564 HD12 HG21 ' A' ' 51' ' ' THR . 72.2 mt -112.4 -40.79 4.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.939 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -143.56 110.95 5.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 74.33 110.879 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.44 ' HB3' HD21 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -118.2 36.96 4.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 73.44 110.812 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -105.54 -45.0 4.55 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 71.52 110.852 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' A' ' 40' ' ' SER . 0.1 OUTLIER -72.09 154.95 40.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.173 -0.467 . . . . 51.54 110.886 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.443 ' C ' ' O ' ' A' ' 39' ' ' LYS . 2.7 t -34.28 -51.63 0.45 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.13 110.871 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 45.2 m95 -91.21 128.16 36.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.888 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' HD11 ' A' ' 34' ' ' LEU . 13.1 m0 -80.23 109.33 14.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.253 -0.431 . . . . 73.43 110.893 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.581 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 8.9 ttt180 -79.06 126.32 30.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 63.11 110.878 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.4 m -131.75 175.68 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.146 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.504 ' O ' HD12 ' A' ' 32' ' ' LEU . 5.9 ttp180 -121.97 158.73 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.449 . . . . 64.1 110.87 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.609 ' HA ' HD12 ' A' ' 32' ' ' LEU . 12.0 t-20 -118.02 163.47 16.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.901 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.464 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.3 p -58.0 -22.52 49.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 72.21 110.79 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . 0.433 ' CB ' ' HD2' ' A' ' 50' ' ' LYS . 4.3 mmt -78.36 7.73 6.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 72.12 110.791 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.558 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.23 -3.41 2.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.93 0.395 . . . . 73.14 110.933 -179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HD2' ' CB ' ' A' ' 48' ' ' MET . 6.2 mttt -78.25 163.61 25.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 63.52 110.879 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 HD12 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -138.76 155.03 48.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 50.12 111.142 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -171.11 159.49 31.47 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.701 -0.761 . . . . 74.03 112.468 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.581 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 6.1 m-85 -86.5 138.79 31.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 64.41 110.852 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 42' ' ' TRP . 10.9 m -148.41 150.37 34.01 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.602 0.715 . . . . 52.44 111.093 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 54.0 Cg_endo -69.77 140.84 43.64 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.642 2.228 . . . . 61.04 112.312 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.1 p -72.0 -8.28 53.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 52.15 110.842 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -74.97 -9.33 58.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.33 110.918 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.576 ' CE2' ' HB2' ' A' ' 16' ' ' TYR . 29.0 m-85 -107.54 -32.67 7.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.179 -0.464 . . . . 74.34 110.999 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.506 HG21 HG21 ' A' ' 10' ' ' VAL . 2.4 m -109.78 -177.85 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.071 -0.513 . . . . 74.21 111.149 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.99 137.03 5.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 75.33 110.907 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.547 ' HA ' HG12 ' A' ' 10' ' ' VAL . 6.8 ptp180 -52.77 144.16 14.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.873 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 9' ' ' VAL . 0.1 OUTLIER -106.55 151.4 25.06 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 74.41 110.904 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -99.47 31.56 3.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 72.41 110.93 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.3 t -70.53 -48.43 55.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.163 -0.471 . . . . 44.1 110.889 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.17 92.16 6.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.097 -0.501 . . . . 75.41 111.165 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -96.08 161.13 14.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 63.44 110.876 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -52.98 -50.05 64.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 64.13 111.17 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.77 36.11 0.7 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.236 -0.438 . . . . 64.33 111.148 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' C ' ' OD1' ' A' ' 70' ' ' ASN . . . -102.57 -46.58 4.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 72.4 111.1 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' A' ' 69' ' ' ALA . 3.1 m120 -150.3 -43.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.158 -0.474 . . . . 73.53 110.848 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 m -48.86 155.57 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 51.53 110.866 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.094 -0.503 . . . . 72.02 110.826 -179.797 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.446 -0.262 . . . . 63.14 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 p -129.11 -57.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.902 0.382 . . . . 53.31 110.799 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.17 158.45 0.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 74.42 111.13 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.9 mtt -173.99 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.242 -0.436 . . . . 71.24 110.83 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.73 -71.47 0.59 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.214 -0.448 . . . . 51.11 111.079 179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -172.67 132.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 74.54 110.928 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -130.69 110.52 11.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.127 -0.488 . . . . 74.52 110.882 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.525 HG11 HD23 ' A' ' 34' ' ' LEU . 24.9 t -131.64 145.43 35.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.157 -0.474 . . . . 61.52 111.098 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.05 140.53 48.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 70.24 111.144 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.876 HG12 ' HA ' ' A' ' 61' ' ' ARG . 16.3 m -130.76 151.38 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 64.32 111.168 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.3 p -113.05 141.58 28.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.48 . . . . 62.31 111.148 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -89.89 140.71 29.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 24.33 111.113 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.415 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 1.5 mtpp -104.06 -27.81 11.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 70.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.415 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 65.9 m-85 -133.35 160.54 37.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 73.24 110.849 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.92 134.11 35.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 65.31 110.847 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.554 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 5.5 t80 -128.76 149.22 50.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.935 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' N ' ' A' ' 19' ' ' GLN . 96.9 t -113.53 108.25 25.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.081 -0.508 . . . . 64.03 111.131 179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.583 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -41.7 91.05 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 74.22 111.094 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' A' ' 17' ' ' VAL . 0.4 OUTLIER -34.83 -67.06 0.15 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 75.43 110.889 -179.964 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -87.5 147.54 25.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.444 . . . . 73.45 110.888 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.97 -16.11 6.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 73.51 110.965 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -81.02 -29.49 35.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.091 -0.504 . . . . 75.51 110.94 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.583 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 26.6 mt-10 -70.63 166.96 19.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.882 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 ' N ' ' A' ' 25' ' ' ASP . 3.9 tp -109.99 128.73 55.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.889 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.594 ' N ' HD12 ' A' ' 24' ' ' LEU . 6.1 p-10 -71.2 148.75 46.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 71.1 110.917 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.482 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -127.34 179.15 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 34.52 111.109 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.482 ' N ' HG13 ' A' ' 26' ' ' ILE . 5.0 tppp? -144.94 140.5 28.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.5 . . . . 53.41 110.873 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.99 138.51 36.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 71.41 110.861 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.85 33.85 23.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.45 . . . . 64.13 110.849 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.04 112.04 23.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 74.32 110.891 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.0 mmm-85 -69.57 121.04 16.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 64.41 110.918 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.464 HD13 HG21 ' A' ' 44' ' ' VAL . 9.7 mt -113.63 168.8 9.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.955 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.8 m-90 -108.77 111.62 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.908 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 37' ' ' ASP . 47.9 tp -75.79 125.83 29.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.216 -0.447 . . . . 64.05 110.917 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.84 HD12 HG21 ' A' ' 51' ' ' THR . 43.3 mt -107.6 -53.78 2.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 64.54 110.833 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.18 110.97 15.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.221 -0.445 . . . . 53.33 110.862 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB3' HD21 ' A' ' 34' ' ' LEU . 3.0 p-10 -118.13 33.19 5.75 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 75.14 110.882 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.56 -45.04 5.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.474 . . . . 64.41 110.85 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' O ' ' C ' ' A' ' 40' ' ' SER . 25.6 mmtt -73.43 150.13 41.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.094 -0.503 . . . . 72.5 110.928 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.449 ' C ' ' O ' ' A' ' 39' ' ' LYS . 74.6 m -34.45 -49.7 0.4 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 73.55 110.897 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 43.0 m95 -85.08 127.06 34.07 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 74.41 110.877 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -79.18 106.88 11.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.255 -0.43 . . . . 74.03 110.864 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 60.6 ttt180 -79.14 117.06 19.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 75.31 110.899 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.464 HG21 HD13 ' A' ' 32' ' ' LEU . 14.7 m -124.11 168.22 17.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 74.14 111.086 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.8 ttp180 -113.88 156.01 24.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.472 . . . . 73.23 110.906 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.418 ' OD1' ' N ' ' A' ' 47' ' ' SER . 8.3 t-20 -117.4 164.4 14.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 64.3 110.916 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.418 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 89.0 p -60.21 -21.68 62.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 53.11 110.825 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.27 9.77 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 72.32 110.849 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.573 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.98 -5.63 2.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.909 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -76.04 141.84 41.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 74.3 110.929 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.84 HG21 HD12 ' A' ' 35' ' ' LEU . 0.8 OUTLIER -133.86 119.9 19.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.15 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.471 ' HA3' ' N ' ' A' ' 24' ' ' LEU . . . -138.43 164.13 25.68 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.709 -0.758 . . . . 51.13 112.438 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 7.8 m-85 -80.2 132.67 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.912 0.387 . . . . 75.11 110.875 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 5.4 m -144.01 151.01 51.32 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.686 0.755 . . . . 63.12 111.123 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.462 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.9 Cg_endo -69.74 154.67 67.53 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.691 2.261 . . . . 75.14 112.381 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -85.98 26.26 1.03 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.444 . . . . 74.33 110.862 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -96.68 -28.5 14.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 72.05 110.859 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -97.27 -35.34 10.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.458 . . . . 72.14 110.893 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 2.4 m -112.82 164.33 8.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.098 -0.501 . . . . 64.32 111.176 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.457 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 2.5 tt0 -164.63 146.65 8.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.898 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.876 ' HA ' HG12 ' A' ' 10' ' ' VAL . 2.2 mtt180 -50.9 143.99 9.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 72.13 110.849 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' HG3' ' N ' ' A' ' 63' ' ' ASN . 0.2 OUTLIER -84.1 148.58 26.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.829 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.407 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.0 m-80 -125.96 45.74 2.57 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.183 -0.462 . . . . 71.22 110.838 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.3 t -59.12 -50.11 75.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 74.53 110.822 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -113.55 -149.53 0.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 53.11 111.097 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 75.6 mtt180 -68.03 140.89 56.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 70.11 110.814 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.77 -16.68 29.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.48 . . . . 70.02 111.114 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -102.64 25.99 8.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 73.43 111.039 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.83 83.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.269 -0.423 . . . . 61.15 111.1 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -119.5 135.77 54.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.161 -0.472 . . . . 71.03 110.859 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -83.21 165.11 19.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.095 -0.502 . . . . 65.45 110.832 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.039 -0.528 . . . . 72.4 110.847 -179.859 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.439 -0.264 . . . . 74.35 112.439 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 86.5 p -77.07 -45.81 25.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.932 0.396 . . . . 62.52 110.91 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 38.5 m -56.67 137.24 54.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.087 -0.506 . . . . 74.52 111.162 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.4 ttm -124.73 -61.92 1.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 53.13 110.895 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.429 ' O ' ' C ' ' A' ' 6' ' ' GLU . . . -57.78 130.02 44.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 71.42 111.142 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' A' ' 5' ' ' ALA . 1.8 tt0 35.98 85.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.254 -0.43 . . . . 72.42 110.857 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -82.21 98.39 8.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.486 . . . . 63.34 110.877 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t -129.68 142.57 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 71.24 111.141 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.0 141.96 45.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 63.12 111.121 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.583 ' CG1' HD12 ' A' ' 34' ' ' LEU . 2.3 m -122.89 159.28 26.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 71.45 111.127 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.575 HG23 ' HD2' ' A' ' 31' ' ' ARG . 7.4 p -123.89 134.37 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.476 . . . . 72.42 111.205 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -83.4 121.11 26.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 70.35 111.126 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.55 ' HE2' ' CE2' ' A' ' 14' ' ' PHE . 17.3 ptmt -83.12 -14.52 53.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.247 -0.433 . . . . 75.11 110.883 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.55 ' CE2' ' HE2' ' A' ' 13' ' ' LYS . 31.1 m-85 -144.32 -173.93 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.9 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -106.13 137.36 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.17 -0.468 . . . . 74.51 110.855 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.431 ' CE2' ' HA ' ' A' ' 18' ' ' ALA . 4.9 t80 -142.01 148.95 39.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.109 -0.496 . . . . 74.33 110.909 -179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 19' ' ' GLN . 36.8 t -112.19 112.19 39.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.11 -0.495 . . . . 74.33 111.146 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.599 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -50.69 86.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.102 -0.499 . . . . 75.23 111.116 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 17' ' ' VAL . 3.3 mm-40 -43.5 -63.87 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 72.52 110.907 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -77.4 144.63 37.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 63.21 110.928 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -60.94 -11.79 9.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.152 -0.476 . . . . 71.12 110.889 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -88.68 -22.24 23.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.084 -0.507 . . . . 61.45 110.888 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.599 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 59.8 mt-10 -77.82 167.63 21.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.898 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.805 HD13 ' N ' ' A' ' 52' ' ' GLY . 9.2 tp -115.77 126.46 54.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.479 . . . . 72.21 110.901 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.37 139.52 55.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.855 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.438 HG13 ' N ' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -118.03 178.24 2.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 75.33 111.102 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' N ' HG13 ' A' ' 26' ' ' ILE . 13.9 tppt? -152.18 140.79 20.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 73.32 110.889 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -51.23 126.51 16.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.41 110.867 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 69.92 32.84 2.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 52.44 110.877 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -114.01 111.3 21.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.889 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HD2' HG23 ' A' ' 11' ' ' VAL . 0.0 OUTLIER -79.86 116.84 20.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.151 -0.477 . . . . 74.22 110.86 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.853 HD12 ' O ' ' A' ' 45' ' ' ARG . 3.3 mm? -101.52 164.76 11.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.205 -0.452 . . . . 71.3 110.916 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 23.6 m-90 -100.65 108.26 20.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.968 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.583 HD12 ' CG1' ' A' ' 10' ' ' VAL . 0.4 OUTLIER -72.58 130.18 40.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.227 -0.442 . . . . 72.12 110.955 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.606 HD12 HG21 ' A' ' 51' ' ' THR . 55.5 mt -113.56 -29.67 7.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.946 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.66 110.8 2.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.459 . . . . 73.05 110.876 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -118.33 43.76 2.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 61.32 110.941 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.09 -45.16 4.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 75.43 110.824 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 40' ' ' SER . 1.7 mmmt -74.31 155.0 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.084 -0.507 . . . . 74.33 110.861 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.44 ' C ' ' O ' ' A' ' 39' ' ' LYS . 1.8 t -34.23 -55.81 0.51 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 61.23 110.881 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.504 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 32.2 m95 -85.33 123.0 30.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.13 -0.486 . . . . 75.14 110.913 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 10.6 m0 -73.84 109.45 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.406 . . . . 73.21 110.889 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.523 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 4.3 ttt85 -78.88 117.22 19.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 74.14 110.922 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.9 m -129.54 170.49 18.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 70.43 111.098 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.853 ' O ' HD12 ' A' ' 32' ' ' LEU . 7.9 ttp180 -110.38 159.51 17.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 63.03 110.887 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.647 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.1 t-20 -117.58 163.51 16.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 74.11 110.897 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.409 ' N ' ' OD1' ' A' ' 46' ' ' ASN . 25.5 p -60.54 -25.45 66.16 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.239 -0.437 . . . . 71.3 110.811 -179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -78.52 10.38 3.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 71.22 110.841 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.553 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.27 -4.8 2.21 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 64.34 110.854 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.1 mtpt -80.62 141.87 34.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 HD12 ' A' ' 35' ' ' LEU . 1.9 m -124.84 119.0 27.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 74.14 111.203 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.805 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -133.67 165.26 24.24 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.762 -0.732 . . . . 64.33 112.521 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 4.0 m-85 -84.91 130.84 34.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 71.33 110.878 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.8 m -140.34 151.05 63.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.59 0.71 . . . . 54.41 111.171 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.504 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.6 Cg_endo -69.7 155.83 65.09 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.714 2.276 . . . . 72.12 112.326 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.9 p -92.91 27.24 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 73.53 110.904 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -96.53 -25.57 15.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.151 -0.477 . . . . 63.31 110.834 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.409 ' CD1' ' N ' ' A' ' 58' ' ' TYR . 2.1 m-85 -106.63 -26.81 11.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.46 . . . . 61.23 110.92 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.478 ' HB ' ' CG2' ' A' ' 10' ' ' VAL . 5.0 m -111.25 158.22 11.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 43.44 111.141 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.413 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 9.8 tt0 -163.91 143.75 8.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 53.43 110.901 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.52 139.07 39.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 71.31 110.837 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 179.15 0.6 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.189 -0.46 . . . . 70.44 110.873 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -122.74 41.17 3.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 62.11 110.861 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 29.6 t -87.72 -61.74 1.65 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 62.54 110.846 -179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.88 -39.93 94.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.486 . . . . 74.02 111.057 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 57.4 170.13 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.472 . . . . 73.12 110.891 -179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.34 -43.25 11.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 51.12 111.114 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -47.14 -55.65 8.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 32.1 111.123 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.49 151.93 3.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.145 -0.48 . . . . 65.51 111.164 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 59.61 102.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.246 -0.434 . . . . 75.02 110.83 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 72' ' ' SER . 1.6 t -108.09 99.49 8.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.827 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.433 ' C ' ' O ' ' A' ' 71' ' ' SER . 34.5 t . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 74.3 110.81 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.516 -0.233 . . . . 61.21 112.516 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 p -160.74 173.93 14.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.837 0.351 . . . . 71.12 110.914 -179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -45.96 118.96 2.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 73.21 111.174 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 2.7 ttm -167.82 -50.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 70.12 110.884 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -80.66 155.02 27.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.45 . . . . 72.11 111.101 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 66.12 104.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 73.23 110.87 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -153.65 126.64 8.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 72.25 110.944 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.49 ' CG1' HD23 ' A' ' 34' ' ' LEU . 73.2 t -130.17 146.46 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 74.43 111.166 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.91 136.09 60.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 60.14 111.121 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.474 HG12 ' CA ' ' A' ' 61' ' ' ARG . 16.4 m -124.54 134.23 67.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 74.41 111.049 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.414 HG22 ' N ' ' A' ' 12' ' ' ALA . 7.4 p -99.89 152.74 4.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.105 -0.498 . . . . 63.23 111.126 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.414 ' N ' HG22 ' A' ' 11' ' ' VAL . . . -99.11 141.63 31.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.15 -0.477 . . . . 64.11 111.018 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 14' ' ' PHE . 2.5 mtpt -100.1 -25.28 14.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 72.5 110.884 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 13' ' ' LYS . 72.0 m-85 -132.95 177.3 7.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.892 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -98.45 138.38 35.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 74.44 110.907 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.49 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 5.5 t80 -139.47 149.13 43.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.482 . . . . 72.12 110.906 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.492 ' O ' ' N ' ' A' ' 19' ' ' GLN . 49.5 t -112.04 110.19 31.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.15 -0.477 . . . . 73.12 111.14 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.597 ' HB1' ' HB2' ' A' ' 23' ' ' GLU . . . -51.75 85.67 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 64.2 111.11 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 17' ' ' VAL . 4.5 mm-40 -43.73 -58.08 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 74.02 110.83 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -83.08 145.32 29.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 73.32 110.873 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -62.86 -9.78 10.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 65.21 110.879 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 66.6 tt0 -87.17 -29.04 22.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 70.35 110.86 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.597 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 44.6 mt-10 -72.48 168.8 17.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.21 110.875 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.82 HD13 ' N ' ' A' ' 52' ' ' GLY . 8.4 tp -114.99 126.25 54.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.154 -0.476 . . . . 74.44 110.89 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.04 135.52 55.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 72.12 110.931 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 16' ' ' TYR . 0.6 OUTLIER -118.02 178.09 2.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.174 -0.467 . . . . 54.32 111.108 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' N ' HG13 ' A' ' 26' ' ' ILE . 12.8 tppt? -152.46 146.32 25.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.924 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -55.09 123.02 12.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 75.42 110.937 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 71.24 34.8 1.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 73.2 110.934 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -109.87 123.66 49.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.085 -0.507 . . . . 65.02 110.906 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.697 ' C ' HD22 ' A' ' 32' ' ' LEU . 5.4 mmm-85 -87.5 127.26 35.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.931 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.832 HD12 ' O ' ' A' ' 45' ' ' ARG . 2.9 mm? -120.57 166.11 14.09 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.192 -0.458 . . . . 65.22 110.884 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 22.7 m-90 -102.41 108.31 19.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.198 -0.456 . . . . 74.44 110.887 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.833 HD11 ' HB3' ' A' ' 37' ' ' ASP . 40.1 tp -72.65 126.99 31.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.986 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.867 HD12 HG21 ' A' ' 51' ' ' THR . 80.7 mt -109.08 -54.3 2.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 64.22 110.906 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.54 111.4 12.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.861 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.833 ' HB3' HD11 ' A' ' 34' ' ' LEU . 5.2 p-10 -118.02 35.69 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.471 . . . . 72.31 110.931 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.53 -45.03 7.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 32.34 110.839 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.432 ' O ' ' C ' ' A' ' 40' ' ' SER . 14.7 mmtt -77.67 152.33 33.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.872 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 39' ' ' LYS . 5.1 t -34.43 -48.99 0.37 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.188 -0.46 . . . . 65.24 110.824 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.524 ' CZ3' ' HD3' ' A' ' 55' ' ' PRO . 39.6 m95 -84.93 120.44 26.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.166 -0.47 . . . . 74.42 110.899 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.495 ' N ' ' O ' ' A' ' 54' ' ' VAL . 8.0 m0 -74.41 110.16 8.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.286 -0.415 . . . . 73.51 110.866 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.446 ' HB2' ' CE1' ' A' ' 53' ' ' PHE . 37.3 ttt85 -79.86 116.76 20.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.174 -0.466 . . . . 73.41 110.849 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' HD22 ' A' ' 24' ' ' LEU . 13.5 m -127.21 170.11 17.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 75.54 111.07 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.832 ' O ' HD12 ' A' ' 32' ' ' LEU . 6.4 ttp180 -109.66 158.81 17.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.143 -0.481 . . . . 54.22 110.882 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.673 ' HB2' HD21 ' A' ' 24' ' ' LEU . 8.6 t-20 -118.03 160.58 21.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.92 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 90.3 p -57.64 -25.4 60.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 73.41 110.862 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 6.4 mmt -78.65 10.72 3.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.157 -0.474 . . . . 71.04 110.943 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.551 ' ND2' ' C ' ' A' ' 49' ' ' ASN . 0.0 OUTLIER 74.1 -4.04 2.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 73.44 110.868 -179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -82.0 141.88 32.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 65.31 110.857 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.867 HG21 HD12 ' A' ' 35' ' ' LEU . 1.0 OUTLIER -126.64 119.05 26.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.173 -0.467 . . . . 71.11 111.107 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.82 ' N ' HD13 ' A' ' 24' ' ' LEU . . . -131.65 165.37 23.35 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.75 -0.738 . . . . 61.24 112.5 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.446 ' CE1' ' HB2' ' A' ' 43' ' ' ARG . 3.9 m-85 -83.66 139.23 32.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.845 0.355 . . . . 74.44 110.905 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.495 ' O ' ' N ' ' A' ' 42' ' ' TRP . 4.3 m -149.74 151.2 32.31 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.661 0.743 . . . . 75.11 111.125 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.524 ' HD3' ' CZ3' ' A' ' 41' ' ' TRP . 53.5 Cg_endo -69.76 155.7 65.27 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.728 2.286 . . . . 73.43 112.335 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 98.4 p -89.96 24.73 2.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.231 -0.441 . . . . 63.12 110.91 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -99.26 -22.69 15.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 51.2 110.854 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.432 ' HB3' ' CD1' ' A' ' 26' ' ' ILE . 29.3 m-85 -102.59 -36.75 8.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.214 -0.448 . . . . 71.23 110.991 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.9 m -114.94 157.23 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 74.02 111.117 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.448 ' C ' ' HB ' ' A' ' 10' ' ' VAL . 33.3 tt0 -164.36 152.87 12.87 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.144 -0.48 . . . . 72.11 110.881 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.474 ' CA ' HG12 ' A' ' 10' ' ' VAL . 8.7 ptm180 -54.63 142.56 27.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 70.55 110.901 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.45 ' HE3' ' CZ ' ' A' ' 31' ' ' ARG . 0.1 OUTLIER -62.68 165.56 6.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.178 -0.464 . . . . 73.42 110.956 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.1 43.23 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.266 -0.424 . . . . 62.41 110.924 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 t -56.8 116.21 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.124 -0.489 . . . . 74.03 110.827 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.55 45.12 1.25 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 74.24 111.111 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.3 mtt85 -124.81 139.16 54.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.249 -0.432 . . . . 72.44 110.923 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.68 -20.03 28.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 62.44 111.116 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -104.01 29.97 5.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 63.12 111.083 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -45.53 132.02 8.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.446 . . . . 71.14 111.118 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -51.99 122.76 8.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 75.35 110.907 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 89.3 p -133.88 82.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 64.3 110.886 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 79.6 p . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.11 110.92 -179.766 . . . . . . . . 0 0 . 1 stop_ save_